[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone

Systemtic Name: [4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone Openeye Name: (3-phenyl-2-thioxo-1H-imidazol-4-yl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: [4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone IUPAC Name: [4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone Traditional Name: [4-(4-methylbenzyl)-1,4-diazepan-1-yl]-(3-phenyl-2-thioxo-4-imidazolin-4-yl)methanone Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CNC(=S)N3C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CNC(=S)N3C4=CC=CC=C4

InChI

InChI=1S/C23H26N4OS/c1-18-8-10-19(11-9-18)17-25-12-5-13-26(15-14-25)22(28)21-16-24-23(29)27(21)20-6-3-2-4-7-20/h2-4,6-11,16H,5,12-15,17H2,1H3,(H,24,29)