2-[3,3-dimethyl-5-(4-phenylpiperazin-1-yl)sulfonyl-2H-indol-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[3,3-dimethyl-5-(4-phenylpiperazin-1-yl)sulfonyl-2H-indol-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[3,3-dimethyl-5-(4-phenylpiperazin-1-yl)sulfonyl-indolin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[3,3-dimethyl-5-[(4-phenyl-1-piperazinyl)sulfonyl]-2H-indol-1-yl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[3,3-dimethyl-5-(4-phenylpiperazin-1-yl)sulfonyl-2H-indol-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[3,3-dimethyl-5-(4-phenylpiperazino)sulfonyl-indolin-1-yl]-1-pyrrolidino-ethanone Formula: C26H34N4O3S MolecularWeight: 482.63816

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C2=C1C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)CC(=O)N5CCCC5)C

Isomeric SMILES

CC1(CN(C2=C1C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)CC(=O)N5CCCC5)C

InChI

InChI=1S/C26H34N4O3S/c1-26(2)20-29(19-25(31)28-12-6-7-13-28)24-11-10-22(18-23(24)26)34(32,33)30-16-14-27(15-17-30)21-8-4-3-5-9-21/h3-5,8-11,18H,6-7,12-17,19-20H2,1-2H3