ethyl 4-azanyl-2-azanylidene-3-[(4-chlorophenyl)carbonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-azanylidene-3-[(4-chlorophenyl)carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-amino-3-[(4-chlorobenzoyl)amino]-2-imino-thiazole-5-carboxylate CAS Name: 4-amino-3-[[(4-chlorophenyl)-oxomethyl]amino]-2-imino-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-3-[(4-chlorobenzoyl)amino]-2-imino-1,3-thiazole-5-carboxylate Traditional Name: 4-amino-3-[(4-chlorobenzoyl)amino]-2-imino-4-thiazoline-5-carboxylic acid ethyl ester Formula: C13H13ClN4O3S MolecularWeight: 340.78532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=N)S1)NC(=O)C2=CC=C(C=C2)Cl)N

Isomeric SMILES

CCOC(=O)C1=C(N(C(=N)S1)NC(=O)C2=CC=C(C=C2)Cl)N

InChI

InChI=1S/C13H13ClN4O3S/c1-2-21-12(20)9-10(15)18(13(16)22-9)17-11(19)7-3-5-8(14)6-4-7/h3-6,16H,2,15H2,1H3,(H,17,19)