(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) (Z)-2-(5-phenyl-1,2,3,4-tetrazol-1-yl)-3-thiophen-2-yl-prop-2-enoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) (Z)-2-(5-phenyl-1,2,3,4-tetrazol-1-yl)-3-thiophen-2-yl-prop-2-enoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) (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 (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) (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 (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C22H17N5O3S MolecularWeight: 431.46708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=NN2C(=CC3=CC=CS3)C(=O)OC(C4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=NN2/C(=C\C3=CC=CS3)/C(=O)OC(C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C22H17N5O3S/c23-20(28)19(15-8-3-1-4-9-15)30-22(29)18(14-17-12-7-13-31-17)27-21(24-25-26-27)16-10-5-2-6-11-16/h1-14,19H,(H2,23,28)/b18-14-