N-(3-indol-1-ylpropyl)-4-(phenylmethyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(3-indol-1-ylpropyl)-4-(phenylmethyl)sulfonyl-piperazine-1-carboxamide Openeye Name: 4-benzylsulfonyl-N-(3-indol-1-ylpropyl)piperazine-1-carboxamide CAS Name: N-[3-(1-indolyl)propyl]-4-(phenylmethyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: 4-benzylsulfonyl-N-(3-indol-1-ylpropyl)piperazine-1-carboxamide Traditional Name: 4-benzylsulfonyl-N-(3-indol-1-ylpropyl)piperazine-1-carboxamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCCCN2C=CC3=CC=CC=C32)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)NCCCN2C=CC3=CC=CC=C32)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O3S/c28-23(24-12-6-13-25-14-11-21-9-4-5-10-22(21)25)26-15-17-27(18-16-26)31(29,30)19-20-7-2-1-3-8-20/h1-5,7-11,14H,6,12-13,15-19H2,(H,24,28)