(1-propyl-1,2,3,4-tetrazol-5-yl)methyl 2-(cyclopropylcarbonylamino)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 2-(cyclopropylcarbonylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: (1-propyltetrazol-5-yl)methyl 2-(cyclopropanecarbonylamino)-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[cyclopropyl(oxo)methyl]amino]-4-phenyl-3-thiophenecarboxylic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 2-(cyclopropanecarbonylamino)-4-phenylthiophene-3-carboxylate Traditional Name: 2-(cyclopropanecarbonylamino)-4-phenyl-thiophene-3-carboxylic acid (1-propyltetrazol-5-yl)methyl ester Formula: C20H21N5O3S MolecularWeight: 411.47744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C2=C(SC=C2C3=CC=CC=C3)NC(=O)C4CC4

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)C2=C(SC=C2C3=CC=CC=C3)NC(=O)C4CC4

InChI

InChI=1S/C20H21N5O3S/c1-2-10-25-16(22-23-24-25)11-28-20(27)17-15(13-6-4-3-5-7-13)12-29-19(17)21-18(26)14-8-9-14/h3-7,12,14H,2,8-11H2,1H3,(H,21,26)