1-(1-benzothiophen-2-ylcarbonyl)-7-(1,4-diazepan-1-ylcarbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one

Systemtic Name: 1-(1-benzothiophen-2-ylcarbonyl)-7-(1,4-diazepan-1-ylcarbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-(benzothiophene-2-carbonyl)-7-(1,4-diazepane-1-carbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-[1-benzothiophen-2-yl(oxo)methyl]-7-[1,4-diazepan-1-yl(oxo)methyl]-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-(1-benzothiophene-2-carbonyl)-7-(1,4-diazepane-1-carbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-(benzothiophene-2-carbonyl)-7-(1,4-diazepane-1-carbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C30H28N4O3S MolecularWeight: 524.63332

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C2=CC3=C(C=C2)N(C(CC(=O)N3)C4=CC=CC=C4)C(=O)C5=CC6=CC=CC=C6S5

Isomeric SMILES

C1CNCCN(C1)C(=O)C2=CC3=C(C=C2)N(C(CC(=O)N3)C4=CC=CC=C4)C(=O)C5=CC6=CC=CC=C6S5

InChI

InChI=1S/C30H28N4O3S/c35-28-19-25(20-7-2-1-3-8-20)34(30(37)27-18-21-9-4-5-10-26(21)38-27)24-12-11-22(17-23(24)32-28)29(36)33-15-6-13-31-14-16-33/h1-5,7-12,17-18,25,31H,6,13-16,19H2,(H,32,35)