6-[[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]phenanthridine

Systemtic Name: 6-[[1-(4-methoxyphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]phenanthridine Openeye Name: 6-[[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylmethyl]phenanthridine CAS Name: 6-[[[1-(4-methoxyphenyl)-5-tetrazolyl]thio]methyl]phenanthridine IUPAC Name: 6-[[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylmethyl]phenanthridine Traditional Name: 6-[[[1-(4-methoxyphenyl)tetrazol-5-yl]thio]methyl]phenanthridine Formula: C22H17N5OS MolecularWeight: 399.46828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=N2)SCC3=NC4=CC=CC=C4C5=CC=CC=C53

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=N2)SCC3=NC4=CC=CC=C4C5=CC=CC=C53

InChI

InChI=1S/C22H17N5OS/c1-28-16-12-10-15(11-13-16)27-22(24-25-26-27)29-14-21-19-8-3-2-6-17(19)18-7-4-5-9-20(18)23-21/h2-13H,14H2,1H3