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

Systemtic Name: 1-(1-benzothiophen-2-ylcarbonyl)-2-phenyl-7-piperazin-1-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-(benzothiophene-2-carbonyl)-2-phenyl-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-[1-benzothiophen-2-yl(oxo)methyl]-7-[oxo(1-piperazinyl)methyl]-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-(1-benzothiophene-2-carbonyl)-2-phenyl-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-(benzothiophene-2-carbonyl)-2-phenyl-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C29H26N4O3S MolecularWeight: 510.60674

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)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

C1CN(CCN1)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/C29H26N4O3S/c34-27-18-24(19-6-2-1-3-7-19)33(29(36)26-17-20-8-4-5-9-25(20)37-26)23-11-10-21(16-22(23)31-27)28(35)32-14-12-30-13-15-32/h1-11,16-17,24,30H,12-15,18H2,(H,31,34)