[2,5-dimethyl-4-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-1H-pyrrol-3-yl]-piperidin-1-yl-methanone

Systemtic Name: [2,5-dimethyl-4-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-1H-pyrrol-3-yl]-piperidin-1-yl-methanone Openeye Name: [4-(4-benzylpiperazin-1-yl)sulfonyl-2,5-dimethyl-1H-pyrrol-3-yl]-(1-piperidyl)methanone CAS Name: [2,5-dimethyl-4-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-1H-pyrrol-3-yl]-(1-piperidinyl)methanone IUPAC Name: [4-(4-benzylpiperazin-1-yl)sulfonyl-2,5-dimethyl-1H-pyrrol-3-yl]-piperidin-1-ylmethanone Traditional Name: [4-(4-benzylpiperazino)sulfonyl-2,5-dimethyl-1H-pyrrol-3-yl]-piperidino-methanone Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)C(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C(=C(N1)C)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C23H32N4O3S/c1-18-21(23(28)26-11-7-4-8-12-26)22(19(2)24-18)31(29,30)27-15-13-25(14-16-27)17-20-9-5-3-6-10-20/h3,5-6,9-10,24H,4,7-8,11-17H2,1-2H3