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

Systemtic Name: 1-[(3-carbamothioylphenyl)methyl]-N-(pyridin-4-ylmethyl)indole-2-carboxamide Openeye Name: 1-[(3-carbamothioylphenyl)methyl]-N-(4-pyridylmethyl)indole-2-carboxamide CAS Name: 1-[(3-carbamothioylphenyl)methyl]-N-(pyridin-4-ylmethyl)-2-indolecarboxamide IUPAC Name: 1-[(3-carbamothioylphenyl)methyl]-N-(pyridin-4-ylmethyl)indole-2-carboxamide Traditional Name: N-(4-pyridylmethyl)-1-(3-thiocarbamoylbenzyl)indole-2-carboxamide Formula: C23H20N4OS MolecularWeight: 400.4961

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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)NCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2CC3=CC=CC(=C3)C(=S)N)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C23H20N4OS/c24-22(29)19-6-3-4-17(12-19)15-27-20-7-2-1-5-18(20)13-21(27)23(28)26-14-16-8-10-25-11-9-16/h1-13H,14-15H2,(H2,24,29)(H,26,28)