N-methyl-N-[2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-methyl-N-[2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-methyl-N-[2-[4-(m-tolylmethyl)piperazin-1-yl]-2-oxo-ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-methyl-N-[2-[4-[(3-methylphenyl)methyl]-1-piperazinyl]-2-oxoethyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-methyl-N-[2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-2-oxoethyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-keto-2-[4-(3-methylbenzyl)piperazino]ethyl]-N-methyl-4-pyrrolidinosulfonyl-benzamide Formula: C26H34N4O4S MolecularWeight: 498.63756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)CN(C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)CN(C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C26H34N4O4S/c1-21-6-5-7-22(18-21)19-28-14-16-29(17-15-28)25(31)20-27(2)26(32)23-8-10-24(11-9-23)35(33,34)30-12-3-4-13-30/h5-11,18H,3-4,12-17,19-20H2,1-2H3