4-[(4-amino-2-methyl-5-pyrimidinylmethyl)(formyl)amino]-3-(2-hydroxyethyl)-2-thiapent-3-enyl benzoate
한글명:4-[(4-amino-2-methyl-5-pyrimidinylmethyl)(formyl)amino]-3-(2-hydroxyethyl)-2-thiapent-3-enyl benzoate
카스 번호18481-26-0
상품명:4-[(4-amino-2-methyl-5-pyrimidinylmethyl)(formyl)amino]-3-(2-hydroxyethyl)-2-thiapent-3-enyl benzoate
CBNumberCB8897701
분자식C20H24N4O4S
포뮬러 무게416.49396
MOL 파일18481-26-0.mol
화학적 성질
InChI | InChI=1S/C20H24N4O4S/c1-14(24(12-26)11-17-10-22-15(2)23-19(17)21)18(8-9-25)29-13-28-20(27)16-6-4-3-5-7-16/h3-7,10,12,25H,8-9,11,13H2,1-2H3,(H2,21,22,23) |
InChIKey | KZZQSQPXTWSHLI-UHFFFAOYSA-N |
SMILES | C(N(CC1=CN=C(C)N=C1N)C(C)=C(SCOC(=O)C1=CC=CC=C1)CCO)=O |