6-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenanthridine

Systemtic Name: 6-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenanthridine Openeye Name: 6-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenanthridine CAS Name: 6-[[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]methyl]phenanthridine IUPAC Name: 6-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]phenanthridine Traditional Name: 6-[[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]methyl]phenanthridine Formula: C24H20N4S2 MolecularWeight: 428.5724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=NC4=CC=CC=C4C5=CC=CC=C53)CC6=CC=CS6

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=NC4=CC=CC=C4C5=CC=CC=C53)CC6=CC=CS6

InChI

InChI=1S/C24H20N4S2/c1-2-9-20-18(7-1)19-8-3-4-10-21(19)25-22(20)15-30-24-27-26-23(28(24)16-11-12-16)14-17-6-5-13-29-17/h1-10,13,16H,11-12,14-15H2