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

Systemtic Name: 3-[1-(phenylmethyl)indol-3-yl]-1-[4-(3-phenylprop-2-enyl)piperazin-1-yl]-3-thiophen-2-yl-propan-1-one Openeye Name: 3-(1-benzylindol-3-yl)-1-(4-cinnamylpiperazin-1-yl)-3-(2-thienyl)propan-1-one CAS Name: 3-[1-(phenylmethyl)-3-indolyl]-1-[4-(3-phenylprop-2-enyl)-1-piperazinyl]-3-thiophen-2-yl-1-propanone IUPAC Name: 3-(1-benzylindol-3-yl)-1-[4-(3-phenylprop-2-enyl)piperazin-1-yl]-3-thiophen-2-ylpropan-1-one Traditional Name: 3-(1-benzylindol-3-yl)-1-(4-cinnamylpiperazino)-3-(2-thienyl)propan-1-one Formula: C35H35N3OS MolecularWeight: 545.7369

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC=CC2=CC=CC=C2)C(=O)CC(C3=CC=CS3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CC=CC2=CC=CC=C2)C(=O)CC(C3=CC=CS3)C4=CN(C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C35H35N3OS/c39-35(37-22-20-36(21-23-37)19-9-15-28-11-3-1-4-12-28)25-31(34-18-10-24-40-34)32-27-38(26-29-13-5-2-6-14-29)33-17-8-7-16-30(32)33/h1-18,24,27,31H,19-23,25-26H2