ethyl 2-[(1R)-2-(1H-indol-3-yl)-1-(phenylmethoxycarbonylamino)ethyl]-5-propyl-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[(1R)-2-(1H-indol-3-yl)-1-(phenylmethoxycarbonylamino)ethyl]-5-propyl-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[(1R)-1-(benzyloxycarbonylamino)-2-(1H-indol-3-yl)ethyl]-5-propyl-thiazole-4-carboxylate CAS Name: 2-[(1R)-2-(1H-indol-3-yl)-1-(phenylmethoxycarbonylamino)ethyl]-5-propyl-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1R)-2-(1H-indol-3-yl)-1-(phenylmethoxycarbonylamino)ethyl]-5-propyl-1,3-thiazole-4-carboxylate Traditional Name: 2-[(1R)-1-(benzyloxycarbonylamino)-2-(1H-indol-3-yl)ethyl]-5-propyl-thiazole-4-carboxylic acid ethyl ester Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=C(S1)C(CC2=CNC3=CC=CC=C32)NC(=O)OCC4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCCC1=C(N=C(S1)[C@@H](CC2=CNC3=CC=CC=C32)NC(=O)OCC4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C27H29N3O4S/c1-3-10-23-24(26(31)33-4-2)30-25(35-23)22(15-19-16-28-21-14-9-8-13-20(19)21)29-27(32)34-17-18-11-6-5-7-12-18/h5-9,11-14,16,22,28H,3-4,10,15,17H2,1-2H3,(H,29,32)/t22-/m1/s1