N-(3-aminocarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-oxidanylidene-isochromene-3-carboxamide

Systemtic Name: N-(3-aminocarbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-oxidanylidene-isochromene-3-carboxamide Openeye Name: N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-oxo-isochromene-3-carboxamide CAS Name: N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-oxo-2-benzopyran-3-carboxamide IUPAC Name: N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-oxoisochromene-3-carboxamide Traditional Name: N-(3-carbamoyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-1-keto-isochromene-3-carboxamide Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2C(=O)N)NC(=O)C3=CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2C(=O)N)NC(=O)C3=CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C20H18N2O4S/c21-17(23)16-13-8-2-1-3-9-15(13)27-19(16)22-18(24)14-10-11-6-4-5-7-12(11)20(25)26-14/h4-7,10H,1-3,8-9H2,(H2,21,23)(H,22,24)