pyrrolidin-1-yl-[1,2,5-trimethyl-4-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-pyrrol-3-yl]methanone

Systemtic Name: pyrrolidin-1-yl-[1,2,5-trimethyl-4-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-pyrrol-3-yl]methanone Openeye Name: [4-(4-benzylpiperazin-1-yl)sulfonyl-1,2,5-trimethyl-pyrrol-3-yl]-pyrrolidin-1-yl-methanone CAS Name: 1-pyrrolidinyl-[1,2,5-trimethyl-4-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-3-pyrrolyl]methanone IUPAC Name: [4-(4-benzylpiperazin-1-yl)sulfonyl-1,2,5-trimethylpyrrol-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [4-(4-benzylpiperazino)sulfonyl-1,2,5-trimethyl-pyrrol-3-yl]-pyrrolidino-methanone Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)C(=O)N4CCCC4

Isomeric SMILES

CC1=C(C(=C(N1C)C)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)C(=O)N4CCCC4

InChI

InChI=1S/C23H32N4O3S/c1-18-21(23(28)26-11-7-8-12-26)22(19(2)24(18)3)31(29,30)27-15-13-25(14-16-27)17-20-9-5-4-6-10-20/h4-6,9-10H,7-8,11-17H2,1-3H3