N-(3-aminocarbonyl-2-methyl-phenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(3-aminocarbonyl-2-methyl-phenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(3-carbamoyl-2-methyl-phenyl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-(3-carbamoyl-2-methylphenyl)-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-(3-carbamoyl-2-methylphenyl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(3-carbamoyl-2-methyl-phenyl)-1-(2-thienylsulfonyl)nipecotamide Formula: C18H21N3O4S2 MolecularWeight: 407.50704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3)C(=O)N

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3)C(=O)N

InChI

InChI=1S/C18H21N3O4S2/c1-12-14(17(19)22)6-2-7-15(12)20-18(23)13-5-3-9-21(11-13)27(24,25)16-8-4-10-26-16/h2,4,6-8,10,13H,3,5,9,11H2,1H3,(H2,19,22)(H,20,23)