propyl 4-chloranyl-3-[5-[(3-methylpyridin-4-yl)carbamoyl]thiophen-2-yl]benzoate

Systemtic Name: propyl 4-chloranyl-3-[5-[(3-methylpyridin-4-yl)carbamoyl]thiophen-2-yl]benzoate Openeye Name: propyl 4-chloro-3-[5-[(3-methyl-4-pyridyl)carbamoyl]-2-thienyl]benzoate CAS Name: 4-chloro-3-[5-[[(3-methyl-4-pyridinyl)amino]-oxomethyl]-2-thiophenyl]benzoic acid propyl ester IUPAC Name: propyl 4-chloro-3-[5-[(3-methylpyridin-4-yl)carbamoyl]thiophen-2-yl]benzoate Traditional Name: 4-chloro-3-[5-[(3-methyl-4-pyridyl)carbamoyl]-2-thienyl]benzoic acid propyl ester Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=C(C=C1)Cl)C2=CC=C(S2)C(=O)NC3=C(C=NC=C3)C

Isomeric SMILES

CCCOC(=O)C1=CC(=C(C=C1)Cl)C2=CC=C(S2)C(=O)NC3=C(C=NC=C3)C

InChI

InChI=1S/C21H19ClN2O3S/c1-3-10-27-21(26)14-4-5-16(22)15(11-14)18-6-7-19(28-18)20(25)24-17-8-9-23-12-13(17)2/h4-9,11-12H,3,10H2,1-2H3,(H,23,24,25)