N-(3,4-dimethylphenyl)-1-methyl-6-oxidanylidene-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-pyrimidine-5-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-1-methyl-6-oxidanylidene-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-pyrimidine-5-carboxamide Openeye Name: 2-[2-(benzylamino)-2-oxo-ethyl]sulfanyl-N-(3,4-dimethylphenyl)-1-methyl-6-oxo-pyrimidine-5-carboxamide CAS Name: N-(3,4-dimethylphenyl)-1-methyl-6-oxo-2-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]-5-pyrimidinecarboxamide IUPAC Name: 2-[2-(benzylamino)-2-oxoethyl]sulfanyl-N-(3,4-dimethylphenyl)-1-methyl-6-oxopyrimidine-5-carboxamide Traditional Name: 2-[[2-(benzylamino)-2-keto-ethyl]thio]-N-(3,4-dimethylphenyl)-6-keto-1-methyl-pyrimidine-5-carboxamide Formula: C23H24N4O3S MolecularWeight: 436.52666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CN=C(N(C2=O)C)SCC(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CN=C(N(C2=O)C)SCC(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C23H24N4O3S/c1-15-9-10-18(11-16(15)2)26-21(29)19-13-25-23(27(3)22(19)30)31-14-20(28)24-12-17-7-5-4-6-8-17/h4-11,13H,12,14H2,1-3H3,(H,24,28)(H,26,29)