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

Systemtic Name: 3-chloranyl-N-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(phenylmethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-benzyl-3-chloro-N-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(phenylmethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-benzyl-3-chloro-N-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-benzothiophene-2-carboxamide Traditional Name: N-benzyl-3-chloro-N-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]benzothiophene-2-carboxamide Formula: C28H23ClN2O2S MolecularWeight: 487.01242

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3=CC=CC=C3)C(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

CCC1=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/C28H23ClN2O2S/c1-2-18-12-13-23-20(14-18)15-21(27(32)30-23)17-31(16-19-8-4-3-5-9-19)28(33)26-25(29)22-10-6-7-11-24(22)34-26/h3-15H,2,16-17H2,1H3,(H,30,32)