1-[4-(4-nitrophenyl)piperazin-1-yl]-3-[1-(phenylmethyl)indol-3-yl]-3-thiophen-2-yl-propan-1-one

Systemtic Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-3-[1-(phenylmethyl)indol-3-yl]-3-thiophen-2-yl-propan-1-one Openeye Name: 3-(1-benzylindol-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]-3-(2-thienyl)propan-1-one CAS Name: 1-[4-(4-nitrophenyl)-1-piperazinyl]-3-[1-(phenylmethyl)-3-indolyl]-3-thiophen-2-yl-1-propanone IUPAC Name: 3-(1-benzylindol-3-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]-3-thiophen-2-ylpropan-1-one Traditional Name: 3-(1-benzylindol-3-yl)-1-[4-(4-nitrophenyl)piperazino]-3-(2-thienyl)propan-1-one Formula: C32H30N4O3S MolecularWeight: 550.6706

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CC(C3=CC=CS3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CC(C3=CC=CS3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C32H30N4O3S/c37-32(34-18-16-33(17-19-34)25-12-14-26(15-13-25)36(38)39)21-28(31-11-6-20-40-31)29-23-35(22-24-7-2-1-3-8-24)30-10-5-4-9-27(29)30/h1-15,20,23,28H,16-19,21-22H2