methyl 3-(2,3-dihydroindol-1-ylcarbothioylcarbamoyl)benzoate

Systemtic Name: methyl 3-(2,3-dihydroindol-1-ylcarbothioylcarbamoyl)benzoate Openeye Name: methyl 3-(indoline-1-carbothioylcarbamoyl)benzoate CAS Name: 3-[[[2,3-dihydroindol-1-yl(sulfanylidene)methyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-(2,3-dihydroindole-1-carbothioylcarbamoyl)benzoate Traditional Name: 3-(indoline-1-carbothioylcarbamoyl)benzoic acid methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)NC(=S)N2CCC3=CC=CC=C32

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)NC(=S)N2CCC3=CC=CC=C32

InChI

InChI=1S/C18H16N2O3S/c1-23-17(22)14-7-4-6-13(11-14)16(21)19-18(24)20-10-9-12-5-2-3-8-15(12)20/h2-8,11H,9-10H2,1H3,(H,19,21,24)