N-(5-chloranyl-2-methoxy-phenyl)-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]benzamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]benzamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-[[(1-phenyl-5-tetrazolyl)thio]methyl]benzamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]benzamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-4-[[(1-phenyltetrazol-5-yl)thio]methyl]benzamide Formula: C22H18ClN5O2S MolecularWeight: 451.92862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)CSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)CSC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C22H18ClN5O2S/c1-30-20-12-11-17(23)13-19(20)24-21(29)16-9-7-15(8-10-16)14-31-22-25-26-27-28(22)18-5-3-2-4-6-18/h2-13H,14H2,1H3,(H,24,29)