N-[(E)-[2-(azepan-1-ylcarbonyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]thiophene-2-carboxamide

Systemtic Name: N-[(E)-[2-(azepan-1-ylcarbonyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]thiophene-2-carboxamide Openeye Name: N-[(E)-[2-(azepane-1-carbonyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]thiophene-2-carboxamide CAS Name: N-[(E)-[2-[1-azepanyl(oxo)methyl]-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-2-thiophenecarboxamide IUPAC Name: N-[(E)-[2-(azepane-1-carbonyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]thiophene-2-carboxamide Traditional Name: N-[(E)-[2-(azepane-1-carbonyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]thiophene-2-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=CS3)CCC2)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=CS3)/CCC2)C(=O)N4CCCCCC4

InChI

InChI=1S/C21H25N3O3S/c1-14-18-15(22-23-20(25)17-10-7-13-28-17)8-6-9-16(18)27-19(14)21(26)24-11-4-2-3-5-12-24/h7,10,13H,2-6,8-9,11-12H2,1H3,(H,23,25)/b22-15+