6-methyl-4-(4-methylsulfanylphenyl)-N-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 6-methyl-4-(4-methylsulfanylphenyl)-N-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: N-benzyl-6-methyl-4-(4-methylsulfanylphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 6-methyl-4-[4-(methylthio)phenyl]-N-(phenylmethyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: N-benzyl-6-methyl-4-(4-methylsulfanylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: N-benzyl-6-methyl-4-[4-(methylthio)phenyl]-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C20H21N3OS2 MolecularWeight: 383.53024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)SC)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)SC)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H21N3OS2/c1-13-17(19(24)21-12-14-6-4-3-5-7-14)18(23-20(25)22-13)15-8-10-16(26-2)11-9-15/h3-11,18H,12H2,1-2H3,(H,21,24)(H2,22,23,25)