[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: [2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid [2-oxo-2-[4-(1-piperidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylanilino)ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid [2-keto-2-(4-piperidinoanilino)ethyl] ester Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=CS1)C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

C=CCNC1=NC(=CS1)C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C20H24N4O3S/c1-2-10-21-20-23-17(14-28-20)19(26)27-13-18(25)22-15-6-8-16(9-7-15)24-11-4-3-5-12-24/h2,6-9,14H,1,3-5,10-13H2,(H,21,23)(H,22,25)