N-[4-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-[4-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-[4-(1-cyclopropyl-5-tetrazolyl)phenyl]-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]-3-[(4-methoxyphenyl)thio]propionamide Formula: C20H21N5O2S MolecularWeight: 395.47804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCC(=O)NC2=CC=C(C=C2)C3=NN=NN3C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)SCCC(=O)NC2=CC=C(C=C2)C3=NN=NN3C4CC4

InChI

InChI=1S/C20H21N5O2S/c1-27-17-8-10-18(11-9-17)28-13-12-19(26)21-15-4-2-14(3-5-15)20-22-23-24-25(20)16-6-7-16/h2-5,8-11,16H,6-7,12-13H2,1H3,(H,21,26)