N-(3,4-dimethylphenyl)-4-methylsulfanyl-2-(4-methylsulfanylphenyl)-6-[(phenylmethyl)amino]pyrimidine-5-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-methylsulfanyl-2-(4-methylsulfanylphenyl)-6-[(phenylmethyl)amino]pyrimidine-5-carboxamide Openeye Name: 4-(benzylamino)-N-(3,4-dimethylphenyl)-6-methylsulfanyl-2-(4-methylsulfanylphenyl)pyrimidine-5-carboxamide CAS Name: N-(3,4-dimethylphenyl)-4-(methylthio)-2-[4-(methylthio)phenyl]-6-[(phenylmethyl)amino]-5-pyrimidinecarboxamide IUPAC Name: 4-(benzylamino)-N-(3,4-dimethylphenyl)-6-methylsulfanyl-2-(4-methylsulfanylphenyl)pyrimidine-5-carboxamide Traditional Name: 4-(benzylamino)-N-(3,4-dimethylphenyl)-6-(methylthio)-2-[4-(methylthio)phenyl]pyrimidine-5-carboxamide Formula: C28H28N4OS2 MolecularWeight: 500.67812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(N=C(N=C2SC)C3=CC=C(C=C3)SC)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(N=C(N=C2SC)C3=CC=C(C=C3)SC)NCC4=CC=CC=C4)C

InChI

InChI=1S/C28H28N4OS2/c1-18-10-13-22(16-19(18)2)30-27(33)24-26(29-17-20-8-6-5-7-9-20)31-25(32-28(24)35-4)21-11-14-23(34-3)15-12-21/h5-16H,17H2,1-4H3,(H,30,33)(H,29,31,32)