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

Systemtic Name: 6-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]phenanthridine Openeye Name: 6-[(1-isopropyltetrazol-5-yl)sulfanylmethyl]phenanthridine CAS Name: 6-[[(1-propan-2-yl-5-tetrazolyl)thio]methyl]phenanthridine IUPAC Name: 6-[(1-propan-2-yltetrazol-5-yl)sulfanylmethyl]phenanthridine Traditional Name: 6-[[(1-isopropyltetrazol-5-yl)thio]methyl]phenanthridine Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=N1)SCC2=NC3=CC=CC=C3C4=CC=CC=C42

Isomeric SMILES

CC(C)N1C(=NN=N1)SCC2=NC3=CC=CC=C3C4=CC=CC=C42

InChI

InChI=1S/C18H17N5S/c1-12(2)23-18(20-21-22-23)24-11-17-15-9-4-3-7-13(15)14-8-5-6-10-16(14)19-17/h3-10,12H,11H2,1-2H3