6-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenanthridine

Systemtic Name: 6-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenanthridine Openeye Name: 6-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenanthridine CAS Name: 6-[[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]phenanthridine IUPAC Name: 6-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenanthridine Traditional Name: 6-[[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]phenanthridine Formula: C23H24N4S MolecularWeight: 388.52846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SCC3=NC4=CC=CC=C4C5=CC=CC=C53

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SCC3=NC4=CC=CC=C4C5=CC=CC=C53

InChI

InChI=1S/C23H24N4S/c1-16-25-26-23(27(16)17-9-3-2-4-10-17)28-15-22-20-13-6-5-11-18(20)19-12-7-8-14-21(19)24-22/h5-8,11-14,17H,2-4,9-10,15H2,1H3