methyl 5-methyl-3-(methylcarbamothioylamino)-1H-indole-2-carboxylate

Systemtic Name: methyl 5-methyl-3-(methylcarbamothioylamino)-1H-indole-2-carboxylate Openeye Name: methyl 5-methyl-3-(methylcarbamothioylamino)-1H-indole-2-carboxylate CAS Name: 5-methyl-3-[[methylamino(sulfanylidene)methyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-methyl-3-(methylcarbamothioylamino)-1H-indole-2-carboxylate Traditional Name: 5-methyl-3-(methylthiocarbamoylamino)-1H-indole-2-carboxylic acid methyl ester Formula: C13H15N3O2S MolecularWeight: 277.3421

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2NC(=S)NC)C(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2NC(=S)NC)C(=O)OC

InChI

InChI=1S/C13H15N3O2S/c1-7-4-5-9-8(6-7)10(16-13(19)14-2)11(15-9)12(17)18-3/h4-6,15H,1-3H3,(H2,14,16,19)