4-chloranyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]butan-2-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]butan-2-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[(1S)-2-methyl-1-[4-(4-pyridylmethyl)piperazine-1-carbonyl]propyl]benzenesulfonamide CAS Name: 4-chloro-N-[(2S)-3-methyl-1-oxo-1-[4-(pyridin-4-ylmethyl)-1-piperazinyl]butan-2-yl]benzenesulfonamide IUPAC Name: 4-chloro-N-[(2S)-3-methyl-1-oxo-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]butan-2-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[(1S)-2-methyl-1-[4-(4-pyridylmethyl)piperazine-1-carbonyl]propyl]benzenesulfonamide Formula: C21H27ClN4O3S MolecularWeight: 450.98208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CC2=CC=NC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)CC2=CC=NC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H27ClN4O3S/c1-16(2)20(24-30(28,29)19-5-3-18(22)4-6-19)21(27)26-13-11-25(12-14-26)15-17-7-9-23-10-8-17/h3-10,16,20,24H,11-15H2,1-2H3/t20-/m0/s1