N-[4-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]naphthalene-1-carboxamide

Systemtic Name: N-[4-[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]naphthalene-1-carboxamide Openeye Name: N-[4-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]naphthalene-1-carboxamide CAS Name: N-[4-[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]phenyl]-1-naphthalenecarboxamide IUPAC Name: N-[4-(5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]naphthalene-1-carboxamide Traditional Name: N-[4-[5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]phenyl]-1-naphthamide Formula: C27H22N4OS MolecularWeight: 450.55478

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H22N4OS/c1-31-25(29-30-27(31)33-18-19-8-3-2-4-9-19)21-14-16-22(17-15-21)28-26(32)24-13-7-11-20-10-5-6-12-23(20)24/h2-17H,18H2,1H3,(H,28,32)