3-chloranyl-N-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(phenylmethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(phenylmethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-benzyl-3-chloro-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(phenylmethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-benzyl-3-chloro-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-benzyl-3-chloro-N-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]benzothiophene-2-carboxamide Formula: C27H21ClN2O3S MolecularWeight: 488.98524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CC=C3)C(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CC=C3)C(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C27H21ClN2O3S/c1-33-20-11-12-22-18(14-20)13-19(26(31)29-22)16-30(15-17-7-3-2-4-8-17)27(32)25-24(28)21-9-5-6-10-23(21)34-25/h2-14H,15-16H2,1H3,(H,29,31)