3-(5-pyridin-2-ylthiophen-2-yl)prop-2-ynyl 4-chloranylbenzoate

Systemtic Name: 3-(5-pyridin-2-ylthiophen-2-yl)prop-2-ynyl 4-chloranylbenzoate Openeye Name: 3-[5-(2-pyridyl)-2-thienyl]prop-2-ynyl 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid 3-[5-(2-pyridinyl)-2-thiophenyl]prop-2-ynyl ester IUPAC Name: 3-(5-pyridin-2-ylthiophen-2-yl)prop-2-ynyl 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid 3-[5-(2-pyridyl)-2-thienyl]prop-2-ynyl ester Formula: C19H12ClNO2S MolecularWeight: 353.82208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC=C(S2)C#CCOC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=NC(=C1)C2=CC=C(S2)C#CCOC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H12ClNO2S/c20-15-8-6-14(7-9-15)19(22)23-13-3-4-16-10-11-18(24-16)17-5-1-2-12-21-17/h1-2,5-12H,13H2