butanedioate; N-methyl-N-[[1-methyl-5-[[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]methyl]pyrrol-2-yl]methyl]butane-1-sulfonamide

Systemtic Name: butanedioate; N-methyl-N-[[1-methyl-5-[[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]methyl]pyrrol-2-yl]methyl]butane-1-sulfonamide Openeye Name: butanedioate; N-[[5-[[4-(2-isopropoxyphenyl)piperazin-1-yl]methyl]-1-methyl-pyrrol-2-yl]methyl]-N-methyl-butane-1-sulfonamide CAS Name: butanedioate; N-methyl-N-[[1-methyl-5-[[4-(2-propan-2-yloxyphenyl)-1-piperazinyl]methyl]-2-pyrrolyl]methyl]-1-butanesulfonamide IUPAC Name: butanedioate; N-methyl-N-[[1-methyl-5-[[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]methyl]pyrrol-2-yl]methyl]butane-1-sulfonamide Traditional Name: N-[[5-[[4-(2-isopropoxyphenyl)piperazino]methyl]-1-methyl-pyrrol-2-yl]methyl]-N-methyl-butane-1-sulfonamide; succinate Formula: C29H44N4O7S-2 MolecularWeight: 592.74726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N(C)CC1=CC=C(N1C)CN2CCN(CC2)C3=CC=CC=C3OC(C)C.C(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCS(=O)(=O)N(C)CC1=CC=C(N1C)CN2CCN(CC2)C3=CC=CC=C3OC(C)C.C(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C25H40N4O3S.C4H6O4/c1-6-7-18-33(30,31)26(4)19-22-12-13-23(27(22)5)20-28-14-16-29(17-15-28)24-10-8-9-11-25(24)32-21(2)3;5-3(6)1-2-4(7)8/h8-13,21H,6-7,14-20H2,1-5H3;1-2H2,(H,5,6)(H,7,8)/p-2