(2S)-2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-N-phenyl-butanamide

Systemtic Name: (2S)-2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-N-phenyl-butanamide Openeye Name: (2S)-2-(4-indan-5-ylsulfonylpiperazin-1-yl)-N-phenyl-butanamide CAS Name: (2S)-2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-N-phenylbutanamide IUPAC Name: (2S)-2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-N-phenylbutanamide Traditional Name: (2S)-2-(4-indan-5-ylsulfonylpiperazino)-N-phenyl-butyramide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CC[C@@H](C(=O)NC1=CC=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C23H29N3O3S/c1-2-22(23(27)24-20-9-4-3-5-10-20)25-13-15-26(16-14-25)30(28,29)21-12-11-18-7-6-8-19(18)17-21/h3-5,9-12,17,22H,2,6-8,13-16H2,1H3,(H,24,27)/t22-/m0/s1