N-(3-acetamidophenyl)-1-azanyl-5-oxidanylidene-6,7,8,9-tetrahydro-4H-thieno[2,3-c]isoquinoline-2-carboxamide

Systemtic Name: N-(3-acetamidophenyl)-1-azanyl-5-oxidanylidene-6,7,8,9-tetrahydro-4H-thieno[2,3-c]isoquinoline-2-carboxamide Openeye Name: N-(3-acetamidophenyl)-1-amino-5-oxo-6,7,8,9-tetrahydro-4H-thieno[2,3-c]isoquinoline-2-carboxamide CAS Name: N-(3-acetamidophenyl)-1-amino-5-oxo-6,7,8,9-tetrahydro-4H-thieno[2,3-c]isoquinoline-2-carboxamide IUPAC Name: N-(3-acetamidophenyl)-1-amino-5-oxo-6,7,8,9-tetrahydro-4H-thieno[2,3-c]isoquinoline-2-carboxamide Traditional Name: N-(3-acetamidophenyl)-1-amino-5-keto-6,7,8,9-tetrahydro-4H-thien[2,3-c]isoquinoline-2-carboxamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)NC(=O)C2=C(C3=C(S2)NC(=O)C4=C3CCCC4)N

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)NC(=O)C2=C(C3=C(S2)NC(=O)C4=C3CCCC4)N

InChI

InChI=1S/C20H20N4O3S/c1-10(25)22-11-5-4-6-12(9-11)23-19(27)17-16(21)15-13-7-2-3-8-14(13)18(26)24-20(15)28-17/h4-6,9H,2-3,7-8,21H2,1H3,(H,22,25)(H,23,27)(H,24,26)