3-azanyl-N-(3-methylbutyl)-5-piperidin-1-ylsulfonyl-1-benzothiophene-2-carboxamide

Systemtic Name: 3-azanyl-N-(3-methylbutyl)-5-piperidin-1-ylsulfonyl-1-benzothiophene-2-carboxamide Openeye Name: 3-amino-N-isopentyl-5-(1-piperidylsulfonyl)benzothiophene-2-carboxamide CAS Name: 3-amino-N-(3-methylbutyl)-5-(1-piperidinylsulfonyl)-1-benzothiophene-2-carboxamide IUPAC Name: 3-amino-N-(3-methylbutyl)-5-piperidin-1-ylsulfonyl-1-benzothiophene-2-carboxamide Traditional Name: 3-amino-N-isoamyl-5-piperidinosulfonyl-benzothiophene-2-carboxamide Formula: C19H27N3O3S2 MolecularWeight: 409.56598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=C(C2=C(S1)C=CC(=C2)S(=O)(=O)N3CCCCC3)N

Isomeric SMILES

CC(C)CCNC(=O)C1=C(C2=C(S1)C=CC(=C2)S(=O)(=O)N3CCCCC3)N

InChI

InChI=1S/C19H27N3O3S2/c1-13(2)8-9-21-19(23)18-17(20)15-12-14(6-7-16(15)26-18)27(24,25)22-10-4-3-5-11-22/h6-7,12-13H,3-5,8-11,20H2,1-2H3,(H,21,23)