1-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-4-(4-methylpiperazin-1-yl)naphthalen-2-ol

Systemtic Name: 1-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-4-(4-methylpiperazin-1-yl)naphthalen-2-ol Openeye Name: 4-(4-methylpiperazin-1-yl)-1-[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]naphthalen-2-ol CAS Name: 1-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-4-(4-methyl-1-piperazinyl)-2-naphthalenol IUPAC Name: 1-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-4-(4-methylpiperazin-1-yl)naphthalen-2-ol Traditional Name: 4-(4-methylpiperazino)-1-[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]-2-naphthol Formula: C25H27N5OS MolecularWeight: 445.57978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C)SC3=C(C=C(C4=CC=CC=C43)N5CCN(CC5)C)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C)SC3=C(C=C(C4=CC=CC=C43)N5CCN(CC5)C)O

InChI

InChI=1S/C25H27N5OS/c1-17-8-10-18(11-9-17)24-26-27-25(29(24)3)32-23-20-7-5-4-6-19(20)21(16-22(23)31)30-14-12-28(2)13-15-30/h4-11,16,31H,12-15H2,1-3H3