1-[(3-carbamothioylphenyl)methyl]-N-(2-pyridin-4-ylethyl)indole-2-carboxamide

Systemtic Name: 1-[(3-carbamothioylphenyl)methyl]-N-(2-pyridin-4-ylethyl)indole-2-carboxamide Openeye Name: 1-[(3-carbamothioylphenyl)methyl]-N-[2-(4-pyridyl)ethyl]indole-2-carboxamide CAS Name: 1-[(3-carbamothioylphenyl)methyl]-N-(2-pyridin-4-ylethyl)-2-indolecarboxamide IUPAC Name: 1-[(3-carbamothioylphenyl)methyl]-N-(2-pyridin-4-ylethyl)indole-2-carboxamide Traditional Name: N-[2-(4-pyridyl)ethyl]-1-(3-thiocarbamoylbenzyl)indole-2-carboxamide Formula: C24H22N4OS MolecularWeight: 414.52268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2CC3=CC=CC(=C3)C(=S)N)C(=O)NCCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2CC3=CC=CC(=C3)C(=S)N)C(=O)NCCC4=CC=NC=C4

InChI

InChI=1S/C24H22N4OS/c25-23(30)20-6-3-4-18(14-20)16-28-21-7-2-1-5-19(21)15-22(28)24(29)27-13-10-17-8-11-26-12-9-17/h1-9,11-12,14-15H,10,13,16H2,(H2,25,30)(H,27,29)