2-[[2-methoxy-5-[(Z)-C-methyl-N-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)amino]carbonimidoyl]phenyl]methylsulfanyl]ethanoate

Systemtic Name: 2-[[2-methoxy-5-[(Z)-C-methyl-N-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)amino]carbonimidoyl]phenyl]methylsulfanyl]ethanoate Openeye Name: 2-[[2-methoxy-5-[(Z)-C-methyl-N-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]carbonimidoyl]phenyl]methylsulfanyl]acetate CAS Name: 2-[[2-methoxy-5-[(1Z)-1-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)hydrazinylidene]ethyl]phenyl]methylthio]acetate IUPAC Name: 2-[[2-methoxy-5-[(Z)-C-methyl-N-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]carbonimidoyl]phenyl]methylsulfanyl]acetate Traditional Name: 2-[[5-[(Z)-N-[(4-keto-6-methyl-1H-pyrimidin-2-yl)amino]-C-methyl-carbonimidoyl]-2-methoxy-benzyl]thio]acetate Formula: C17H19N4O4S- MolecularWeight: 375.42216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)NN=C(C)C2=CC(=C(C=C2)OC)CSCC(=O)[O-]

Isomeric SMILES

CC1=CC(=O)N=C(N1)N/N=C(/C)\C2=CC(=C(C=C2)OC)CSCC(=O)[O-]

InChI

InChI=1S/C17H20N4O4S/c1-10-6-15(22)19-17(18-10)21-20-11(2)12-4-5-14(25-3)13(7-12)8-26-9-16(23)24/h4-7H,8-9H2,1-3H3,(H,23,24)(H2,18,19,21,22)/p-1/b20-11-