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

Systemtic Name: [2-[(3-chlorophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: [2-[(3-chlorophenyl)methyl-methyl-amino]-2-oxo-ethyl] 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid [2-[(3-chlorophenyl)methyl-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(3-chlorophenyl)methyl-methylamino]-2-oxoethyl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid [2-[(3-chlorobenzyl)-methyl-amino]-2-keto-ethyl] ester Formula: C17H18ClN3O3S MolecularWeight: 379.86112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)Cl)C(=O)COC(=O)C2=CSC(=N2)NCC=C

Isomeric SMILES

CN(CC1=CC(=CC=C1)Cl)C(=O)COC(=O)C2=CSC(=N2)NCC=C

InChI

InChI=1S/C17H18ClN3O3S/c1-3-7-19-17-20-14(11-25-17)16(23)24-10-15(22)21(2)9-12-5-4-6-13(18)8-12/h3-6,8,11H,1,7,9-10H2,2H3,(H,19,20)