N-(1,3-benzodioxol-5-ylmethyl)-N-[[7-chloranyl-2-(2-methoxyphenyl)quinolin-3-yl]methyl]-3-methyl-thiophene-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[[7-chloranyl-2-(2-methoxyphenyl)quinolin-3-yl]methyl]-3-methyl-thiophene-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[[7-chloro-2-(2-methoxyphenyl)-3-quinolyl]methyl]-3-methyl-thiophene-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[[7-chloro-2-(2-methoxyphenyl)-3-quinolinyl]methyl]-3-methyl-2-thiophenecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[[7-chloro-2-(2-methoxyphenyl)quinolin-3-yl]methyl]-3-methylthiophene-2-carboxamide Traditional Name: N-[[7-chloro-2-(2-methoxyphenyl)-3-quinolyl]methyl]-3-methyl-N-piperonyl-thiophene-2-carboxamide Formula: C31H25ClN2O4S MolecularWeight: 557.0592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=C(N=C5C=C(C=CC5=C4)Cl)C6=CC=CC=C6OC

Isomeric SMILES

CC1=C(SC=C1)C(=O)N(CC2=CC3=C(C=C2)OCO3)CC4=C(N=C5C=C(C=CC5=C4)Cl)C6=CC=CC=C6OC

InChI

InChI=1S/C31H25ClN2O4S/c1-19-11-12-39-30(19)31(35)34(16-20-7-10-27-28(13-20)38-18-37-27)17-22-14-21-8-9-23(32)15-25(21)33-29(22)24-5-3-4-6-26(24)36-2/h3-15H,16-18H2,1-2H3