4-(4-dimethylaminophenyl)-6-methyl-N-[(E)-(phenylmethylidene)amino]-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 4-(4-dimethylaminophenyl)-6-methyl-N-[(E)-(phenylmethylidene)amino]-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: N-[(E)-benzylideneamino]-4-(4-dimethylaminophenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-(4-dimethylaminophenyl)-6-methyl-N-[(E)-(phenylmethylene)amino]-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: N-[(E)-benzylideneamino]-4-(4-dimethylaminophenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: N-[(E)-benzalamino]-4-(4-dimethylaminophenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)N(C)C)C(=O)NN=CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)N(C)C)C(=O)N/N=C/C3=CC=CC=C3

InChI

InChI=1S/C21H23N5OS/c1-14-18(20(27)25-22-13-15-7-5-4-6-8-15)19(24-21(28)23-14)16-9-11-17(12-10-16)26(2)3/h4-13,19H,1-3H3,(H,25,27)(H2,23,24,28)/b22-13+