2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[(S)-(4-methoxyphenyl)-phenyl-methyl]ethanamide

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[(S)-(4-methoxyphenyl)-phenyl-methyl]ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[(S)-(4-methoxyphenyl)-phenyl-methyl]acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-[(S)-(4-methoxyphenyl)-phenylmethyl]acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[(S)-(4-methoxyphenyl)-phenylmethyl]acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-[(S)-(4-methoxyphenyl)-phenyl-methyl]acetamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)CSC3=NC(=O)C=C(N3)N

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)NC(=O)CSC3=NC(=O)C=C(N3)N

InChI

InChI=1S/C20H20N4O3S/c1-27-15-9-7-14(8-10-15)19(13-5-3-2-4-6-13)23-18(26)12-28-20-22-16(21)11-17(25)24-20/h2-11,19H,12H2,1H3,(H,23,26)(H3,21,22,24,25)/t19-/m0/s1