quinolin-8-ylmethyl (Z)-2-(5-phenyl-1,2,3,4-tetrazol-1-yl)-3-thiophen-2-yl-prop-2-enoate

Systemtic Name: quinolin-8-ylmethyl (Z)-2-(5-phenyl-1,2,3,4-tetrazol-1-yl)-3-thiophen-2-yl-prop-2-enoate Openeye Name: 8-quinolylmethyl (Z)-2-(5-phenyltetrazol-1-yl)-3-(2-thienyl)prop-2-enoate CAS Name: (Z)-2-(5-phenyl-1-tetrazolyl)-3-thiophen-2-yl-2-propenoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl (Z)-2-(5-phenyltetrazol-1-yl)-3-thiophen-2-ylprop-2-enoate Traditional Name: (Z)-2-(5-phenyltetrazol-1-yl)-3-(2-thienyl)acrylic acid 8-quinolylmethyl ester Formula: C24H17N5O2S MolecularWeight: 439.48908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=NN2C(=CC3=CC=CS3)C(=O)OCC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=NN2/C(=C\C3=CC=CS3)/C(=O)OCC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C24H17N5O2S/c30-24(31-16-19-10-4-9-17-11-5-13-25-22(17)19)21(15-20-12-6-14-32-20)29-23(26-27-28-29)18-7-2-1-3-8-18/h1-15H,16H2/b21-15-