2-chloranyl-N-[3-(3-methylpiperidin-1-yl)propyl]-5-thiomorpholin-4-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[3-(3-methylpiperidin-1-yl)propyl]-5-thiomorpholin-4-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[3-(3-methyl-1-piperidyl)propyl]-5-thiomorpholinosulfonyl-benzamide CAS Name: 2-chloro-N-[3-(3-methyl-1-piperidinyl)propyl]-5-thiomorpholin-4-ylsulfonylbenzamide IUPAC Name: 2-chloro-N-[3-(3-methylpiperidin-1-yl)propyl]-5-thiomorpholin-4-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[3-(3-methylpiperidino)propyl]-5-thiomorpholinosulfonyl-benzamide Formula: C20H30ClN3O3S2 MolecularWeight: 460.0535

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCSCC3)Cl

Isomeric SMILES

CC1CCCN(C1)CCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCSCC3)Cl

InChI

InChI=1S/C20H30ClN3O3S2/c1-16-4-2-8-23(15-16)9-3-7-22-20(25)18-14-17(5-6-19(18)21)29(26,27)24-10-12-28-13-11-24/h5-6,14,16H,2-4,7-13,15H2,1H3,(H,22,25)