ethyl 3-[(phenylmethyl)carbamothioylamino]-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[(phenylmethyl)carbamothioylamino]-1H-indole-2-carboxylate Openeye Name: ethyl 3-(benzylcarbamothioylamino)-1H-indole-2-carboxylate CAS Name: 3-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(benzylcarbamothioylamino)-1H-indole-2-carboxylate Traditional Name: 3-(benzylthiocarbamoylamino)-1H-indole-2-carboxylic acid ethyl ester Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=S)NCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1)NC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O2S/c1-2-24-18(23)17-16(14-10-6-7-11-15(14)21-17)22-19(25)20-12-13-8-4-3-5-9-13/h3-11,21H,2,12H2,1H3,(H2,20,22,25)