N-[1-(4-cyclopropylcarbonyl-3-methyl-piperazin-1-yl)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-4-ethyl-benzamide

Systemtic Name: N-[1-(4-cyclopropylcarbonyl-3-methyl-piperazin-1-yl)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-4-ethyl-benzamide Openeye Name: N-[2-[4-(cyclopropanecarbonyl)-3-methyl-piperazin-1-yl]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-4-ethyl-benzamide CAS Name: N-[1-[4-[cyclopropyl(oxo)methyl]-3-methyl-1-piperazinyl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-4-ethylbenzamide IUPAC Name: N-[1-[4-(cyclopropanecarbonyl)-3-methylpiperazin-1-yl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-4-ethylbenzamide Traditional Name: N-[2-[4-(cyclopropanecarbonyl)-3-methyl-piperazino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-4-ethyl-benzamide Formula: C29H34N4O3 MolecularWeight: 486.60526

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)N4CCN(C(C4)C)C(=O)C5CC5

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)N4CCN(C(C4)C)C(=O)C5CC5

InChI

InChI=1S/C29H34N4O3/c1-3-20-8-10-21(11-9-20)27(34)31-26(16-23-17-30-25-7-5-4-6-24(23)25)29(36)32-14-15-33(19(2)18-32)28(35)22-12-13-22/h4-11,17,19,22,26,30H,3,12-16,18H2,1-2H3,(H,31,34)