4-phenethyl-N,6-diphenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 4-phenethyl-N,6-diphenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 4-phenethyl-N,6-diphenyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-phenethyl-N,6-diphenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 4-phenethyl-N,6-diphenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 4-phenethyl-N,6-diphenyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C25H23N3OS MolecularWeight: 413.53462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCC2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H23N3OS/c29-24(26-20-14-8-3-9-15-20)22-21(17-16-18-10-4-1-5-11-18)27-25(30)28-23(22)19-12-6-2-7-13-19/h1-15,21H,16-17H2,(H,26,29)(H2,27,28,30)