N-[(5-bromanyl-2-methoxy-phenyl)methyl]-5-methyl-4-oxidanylidene-thieno[3,2-c]quinoline-2-carboxamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-5-methyl-4-oxidanylidene-thieno[3,2-c]quinoline-2-carboxamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-5-methyl-4-oxo-thieno[3,2-c]quinoline-2-carboxamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-5-methyl-4-oxo-2-thieno[3,2-c]quinolinecarboxamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-5-methyl-4-oxothieno[3,2-c]quinoline-2-carboxamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-4-keto-5-methyl-thieno[3,2-c]quinoline-2-carboxamide Formula: C21H17BrN2O3S MolecularWeight: 457.34028

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C3=C(C1=O)C=C(S3)C(=O)NCC4=C(C=CC(=C4)Br)OC

Isomeric SMILES

CN1C2=CC=CC=C2C3=C(C1=O)C=C(S3)C(=O)NCC4=C(C=CC(=C4)Br)OC

InChI

InChI=1S/C21H17BrN2O3S/c1-24-16-6-4-3-5-14(16)19-15(21(24)26)10-18(28-19)20(25)23-11-12-9-13(22)7-8-17(12)27-2/h3-10H,11H2,1-2H3,(H,23,25)