propyl 5-aminocarbonyl-2-[[1-[(3-chloranylphenoxy)methyl]pyrazol-3-yl]carbonylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: propyl 5-aminocarbonyl-2-[[1-[(3-chloranylphenoxy)methyl]pyrazol-3-yl]carbonylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: propyl 5-carbamoyl-2-[[1-[(3-chlorophenoxy)methyl]pyrazole-3-carbonyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-carbamoyl-2-[[[1-[(3-chlorophenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 5-carbamoyl-2-[[1-[(3-chlorophenoxy)methyl]pyrazole-3-carbonyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-carbamoyl-2-[[1-[(3-chlorophenoxy)methyl]pyrazole-3-carbonyl]amino]-4-methyl-thiophene-3-carboxylic acid propyl ester Formula: C21H21ClN4O5S MolecularWeight: 476.93324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=NN(C=C2)COC3=CC(=CC=C3)Cl

Isomeric SMILES

CCCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=NN(C=C2)COC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H21ClN4O5S/c1-3-9-30-21(29)16-12(2)17(18(23)27)32-20(16)24-19(28)15-7-8-26(25-15)11-31-14-6-4-5-13(22)10-14/h4-8,10H,3,9,11H2,1-2H3,(H2,23,27)(H,24,28)