1-[(3-carbamothioylphenyl)methyl]-N-[(4-dimethylaminophenyl)methyl]-6-methoxy-indole-2-carboxamide

Systemtic Name: 1-[(3-carbamothioylphenyl)methyl]-N-[(4-dimethylaminophenyl)methyl]-6-methoxy-indole-2-carboxamide Openeye Name: 1-[(3-carbamothioylphenyl)methyl]-N-[(4-dimethylaminophenyl)methyl]-6-methoxy-indole-2-carboxamide CAS Name: 1-[(3-carbamothioylphenyl)methyl]-N-[(4-dimethylaminophenyl)methyl]-6-methoxy-2-indolecarboxamide IUPAC Name: 1-[(3-carbamothioylphenyl)methyl]-N-[(4-dimethylaminophenyl)methyl]-6-methoxyindole-2-carboxamide Traditional Name: N-[4-(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=C(C=C1)CNC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C(=S)N)C=C(C=C3)OC

Isomeric SMILES

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

InChI

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