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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)C(CC2=CNC3=CC=CC=C32)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)[C@@H](CC2=CNC3=CC=CC=C32)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H29N3O2S/c1-16-9-11-17(12-10-16)14-26-22(30)21(27-23(28)29-24(2,3)4)13-18-15-25-20-8-6-5-7-19(18)20/h5-12,15,21,25H,13-14H2,1-4H3,(H,26,30)(H,27,28)/t21-/m1/s1