tert-butyl N-[(2R)-1-[(4-ethylphenyl)amino]-3-(1H-indol-3-yl)-1-sulfanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-1-[(4-ethylphenyl)amino]-3-(1H-indol-3-yl)-1-sulfanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-2-(4-ethylanilino)-1-(1H-indol-3-ylmethyl)-2-thioxo-ethyl]carbamate CAS Name: N-[(2R)-1-(4-ethylanilino)-3-(1H-indol-3-yl)-1-sulfanylidenepropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-(4-ethylanilino)-3-(1H-indol-3-yl)-1-sulfanylidenepropan-2-yl]carbamate Traditional Name: N-[(1R)-2-(4-ethylanilino)-1-(1H-indol-3-ylmethyl)-2-thioxo-ethyl]carbamic acid tert-butyl ester Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)C(CC2=CNC3=CC=CC=C32)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)[C@@H](CC2=CNC3=CC=CC=C32)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H29N3O2S/c1-5-16-10-12-18(13-11-16)26-22(30)21(27-23(28)29-24(2,3)4)14-17-15-25-20-9-7-6-8-19(17)20/h6-13,15,21,25H,5,14H2,1-4H3,(H,26,30)(H,27,28)/t21-/m1/s1