N-[3-[2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[2-(1-methyl-2-pyrrolyl)-1-azepanyl]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[2-(1-methylpyrrol-2-yl)azepan-1-yl]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-keto-3-[2-(1-methylpyrrol-2-yl)azepan-1-yl]propyl]thiophene-3-carboxamide Formula: C19H25N3O2S MolecularWeight: 359.4857

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCCCN2C(=O)CCNC(=O)C3=CSC=C3

Isomeric SMILES

CN1C=CC=C1C2CCCCCN2C(=O)CCNC(=O)C3=CSC=C3

InChI

InChI=1S/C19H25N3O2S/c1-21-11-5-7-16(21)17-6-3-2-4-12-22(17)18(23)8-10-20-19(24)15-9-13-25-14-15/h5,7,9,11,13-14,17H,2-4,6,8,10,12H2,1H3,(H,20,24)