N-[2-(1H-indol-3-yl)ethyl]-2-[(3-methylphenyl)carbamoylamino]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-2-[(3-methylphenyl)carbamoylamino]-1,3-thiazole-4-carboxamide Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-2-(m-tolylcarbamoylamino)thiazole-4-carboxamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-2-[[(3-methylanilino)-oxomethyl]amino]-4-thiazolecarboxamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-2-[(3-methylphenyl)carbamoylamino]-1,3-thiazole-4-carboxamide Traditional Name: N-[2-(1H-indol-3-yl)ethyl]-2-(m-tolylcarbamoylamino)thiazole-4-carboxamide Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=NC(=CS2)C(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=NC(=CS2)C(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H21N5O2S/c1-14-5-4-6-16(11-14)25-21(29)27-22-26-19(13-30-22)20(28)23-10-9-15-12-24-18-8-3-2-7-17(15)18/h2-8,11-13,24H,9-10H2,1H3,(H,23,28)(H2,25,26,27,29)