2-[di(propan-2-yl)amino]ethyl 2-[(4-cyanophenyl)carbonylamino]-1,3-thiazole-4-carboxylate

Systemtic Name: 2-[di(propan-2-yl)amino]ethyl 2-[(4-cyanophenyl)carbonylamino]-1,3-thiazole-4-carboxylate Openeye Name: 2-(diisopropylamino)ethyl 2-[(4-cyanobenzoyl)amino]thiazole-4-carboxylate CAS Name: 2-[[(4-cyanophenyl)-oxomethyl]amino]-4-thiazolecarboxylic acid 2-[di(propan-2-yl)amino]ethyl ester IUPAC Name: 2-[di(propan-2-yl)amino]ethyl 2-[(4-cyanobenzoyl)amino]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(4-cyanobenzoyl)amino]thiazole-4-carboxylic acid 2-(diisopropylamino)ethyl ester Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCOC(=O)C1=CSC(=N1)NC(=O)C2=CC=C(C=C2)C#N)C(C)C

Isomeric SMILES

CC(C)N(CCOC(=O)C1=CSC(=N1)NC(=O)C2=CC=C(C=C2)C#N)C(C)C

InChI

InChI=1S/C20H24N4O3S/c1-13(2)24(14(3)4)9-10-27-19(26)17-12-28-20(22-17)23-18(25)16-7-5-15(11-21)6-8-16/h5-8,12-14H,9-10H2,1-4H3,(H,22,23,25)