1-[(3-carbamothioylphenyl)methyl]-N-[[2-(dimethylamino)phenyl]methyl]-6-methoxy-indole-2-carboxamide

Systemtic Name: 1-[(3-carbamothioylphenyl)methyl]-N-[[2-(dimethylamino)phenyl]methyl]-6-methoxy-indole-2-carboxamide Openeye Name: 1-[(3-carbamothioylphenyl)methyl]-N-[[2-(dimethylamino)phenyl]methyl]-6-methoxy-indole-2-carboxamide CAS Name: 1-[(3-carbamothioylphenyl)methyl]-N-[[2-(dimethylamino)phenyl]methyl]-6-methoxy-2-indolecarboxamide IUPAC Name: 1-[(3-carbamothioylphenyl)methyl]-N-[[2-(dimethylamino)phenyl]methyl]-6-methoxyindole-2-carboxamide Traditional Name: N-[2-(dimethylamino)benzyl]-6-methoxy-1-(3-thiocarbamoylbenzyl)indole-2-carboxamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC=C1CNC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C(=S)N)C=C(C=C3)OC

Isomeric SMILES

CN(C)C1=CC=CC=C1CNC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C(=S)N)C=C(C=C3)OC

InChI

InChI=1S/C27H28N4O2S/c1-30(2)23-10-5-4-8-21(23)16-29-27(32)25-14-19-11-12-22(33-3)15-24(19)31(25)17-18-7-6-9-20(13-18)26(28)34/h4-15H,16-17H2,1-3H3,(H2,28,34)(H,29,32)