6-chloranyl-4-oxidanylidene-N-[3-(pyridin-3-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]chromene-2-carboxamide

Systemtic Name: 6-chloranyl-4-oxidanylidene-N-[3-(pyridin-3-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]chromene-2-carboxamide Openeye Name: 6-chloro-4-oxo-N-[3-(3-pyridylmethylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]chromene-2-carboxamide CAS Name: 6-chloro-4-oxo-N-[3-[oxo-(3-pyridinylmethylamino)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-benzopyran-2-carboxamide IUPAC Name: 6-chloro-4-oxo-N-[3-(pyridin-3-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]chromene-2-carboxamide Traditional Name: 6-chloro-4-keto-N-[3-(3-pyridylmethylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]chromene-2-carboxamide Formula: C25H20ClN3O4S MolecularWeight: 493.962

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C25H20ClN3O4S/c26-15-7-8-19-17(10-15)18(30)11-20(33-19)23(31)29-25-22(16-5-1-2-6-21(16)34-25)24(32)28-13-14-4-3-9-27-12-14/h3-4,7-12H,1-2,5-6,13H2,(H,28,32)(H,29,31)