(1-propyl-1,2,3,4-tetrazol-5-yl)methyl (Z)-3-(3-methylphenyl)-2-thiophen-2-yl-prop-2-enoate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl (Z)-3-(3-methylphenyl)-2-thiophen-2-yl-prop-2-enoate Openeye Name: (1-propyltetrazol-5-yl)methyl (Z)-3-(m-tolyl)-2-(2-thienyl)prop-2-enoate CAS Name: (Z)-3-(3-methylphenyl)-2-thiophen-2-yl-2-propenoic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl (Z)-3-(3-methylphenyl)-2-thiophen-2-ylprop-2-enoate Traditional Name: (Z)-3-(m-tolyl)-2-(2-thienyl)acrylic acid (1-propyltetrazol-5-yl)methyl ester Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C(=CC2=CC(=CC=C2)C)C3=CC=CS3

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)/C(=C/C2=CC(=CC=C2)C)/C3=CC=CS3

InChI

InChI=1S/C19H20N4O2S/c1-3-9-23-18(20-21-22-23)13-25-19(24)16(17-8-5-10-26-17)12-15-7-4-6-14(2)11-15/h4-8,10-12H,3,9,13H2,1-2H3/b16-12+