methyl 4-[[(1-methyl-2-sulfanylidene-3H-indol-3-yl)carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[(1-methyl-2-sulfanylidene-3H-indol-3-yl)carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(1-methyl-2-thioxo-indoline-3-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[(1-methyl-2-sulfanylidene-3H-indol-3-yl)-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(1-methyl-2-sulfanylidene-3H-indole-3-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(1-methyl-2-thioxo-indoline-3-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(C1=S)C(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CN1C2=CC=CC=C2C(C1=S)C(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H18N2O3S/c1-21-15-6-4-3-5-14(15)16(18(21)25)17(22)20-11-12-7-9-13(10-8-12)19(23)24-2/h3-10,16H,11H2,1-2H3,(H,20,22)