N-[(5-methyl-1-propyl-imidazol-4-yl)methyl]-N-(2-sulfanylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide

Systemtic Name: N-[(5-methyl-1-propyl-imidazol-4-yl)methyl]-N-(2-sulfanylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Openeye Name: N-[(5-methyl-1-propyl-imidazol-4-yl)methyl]-N-(2-sulfanylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide CAS Name: N-(2-mercaptophenyl)-N-[(5-methyl-1-propyl-4-imidazolyl)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide IUPAC Name: N-[(5-methyl-1-propylimidazol-4-yl)methyl]-N-(2-sulfanylphenyl)-2,3-dihydro-1H-1-benzazepine-4-carboxamide Traditional Name: N-(2-mercaptophenyl)-N-[(5-methyl-1-propyl-imidazol-4-yl)methyl]-2,3-dihydro-1H-1-benzazepine-4-carboxamide Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC(=C1C)CN(C2=CC=CC=C2S)C(=O)C3=CC4=CC=CC=C4NCC3

Isomeric SMILES

CCCN1C=NC(=C1C)CN(C2=CC=CC=C2S)C(=O)C3=CC4=CC=CC=C4NCC3

InChI

InChI=1S/C25H28N4OS/c1-3-14-28-17-27-22(18(28)2)16-29(23-10-6-7-11-24(23)31)25(30)20-12-13-26-21-9-5-4-8-19(21)15-20/h4-11,15,17,26,31H,3,12-14,16H2,1-2H3