ethyl 4-(2,3-dihydro-1H-inden-5-ylcarbamothioylamino)benzoate

Systemtic Name: ethyl 4-(2,3-dihydro-1H-inden-5-ylcarbamothioylamino)benzoate Openeye Name: ethyl 4-(indan-5-ylcarbamothioylamino)benzoate CAS Name: 4-[[(2,3-dihydro-1H-inden-5-ylamino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(2,3-dihydro-1H-inden-5-ylcarbamothioylamino)benzoate Traditional Name: 4-(indan-5-ylthiocarbamoylamino)benzoic acid ethyl ester Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC3=C(CCC3)C=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C19H20N2O2S/c1-2-23-18(22)14-7-9-16(10-8-14)20-19(24)21-17-11-6-13-4-3-5-15(13)12-17/h6-12H,2-5H2,1H3,(H2,20,21,24)