2-azanyl-6-chloranyl-N-[(1-propylsulfonyl-4-pyridin-2-yl-piperidin-4-yl)methyl]benzamide

Systemtic Name: 2-azanyl-6-chloranyl-N-[(1-propylsulfonyl-4-pyridin-2-yl-piperidin-4-yl)methyl]benzamide Openeye Name: 2-amino-6-chloro-N-[[1-propylsulfonyl-4-(2-pyridyl)-4-piperidyl]methyl]benzamide CAS Name: 2-amino-6-chloro-N-[[1-propylsulfonyl-4-(2-pyridinyl)-4-piperidinyl]methyl]benzamide IUPAC Name: 2-amino-6-chloro-N-[(1-propylsulfonyl-4-pyridin-2-ylpiperidin-4-yl)methyl]benzamide Traditional Name: 2-amino-6-chloro-N-[[1-propylsulfonyl-4-(2-pyridyl)-4-piperidyl]methyl]benzamide Formula: C21H27ClN4O3S MolecularWeight: 450.98208

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC(CC1)(CNC(=O)C2=C(C=CC=C2Cl)N)C3=CC=CC=N3

Isomeric SMILES

CCCS(=O)(=O)N1CCC(CC1)(CNC(=O)C2=C(C=CC=C2Cl)N)C3=CC=CC=N3

InChI

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