(3-chloranyl-4-methyl-quinolin-2-yl)methyl 2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: (3-chloranyl-4-methyl-quinolin-2-yl)methyl 2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: (3-chloro-4-methyl-2-quinolyl)methyl 2-[5-(2-thienyl)tetrazol-2-yl]acetate CAS Name: 2-(5-thiophen-2-yl-2-tetrazolyl)acetic acid (3-chloro-4-methyl-2-quinolinyl)methyl ester IUPAC Name: (3-chloro-4-methylquinolin-2-yl)methyl 2-(5-thiophen-2-yltetrazol-2-yl)acetate Traditional Name: 2-[5-(2-thienyl)tetrazol-2-yl]acetic acid (3-chloro-4-methyl-2-quinolyl)methyl ester Formula: C18H14ClN5O2S MolecularWeight: 399.85406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CN3N=C(N=N3)C4=CC=CS4)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CN3N=C(N=N3)C4=CC=CS4)Cl

InChI

InChI=1S/C18H14ClN5O2S/c1-11-12-5-2-3-6-13(12)20-14(17(11)19)10-26-16(25)9-24-22-18(21-23-24)15-7-4-8-27-15/h2-8H,9-10H2,1H3