4-[3-[2-(1H-indol-3-yl)ethylsulfanyl]-5-naphthalen-1-yl-1,2,4-triazol-4-yl]butan-1-amine

Systemtic Name: 4-[3-[2-(1H-indol-3-yl)ethylsulfanyl]-5-naphthalen-1-yl-1,2,4-triazol-4-yl]butan-1-amine Openeye Name: 4-[3-[2-(1H-indol-3-yl)ethylsulfanyl]-5-(1-naphthyl)-1,2,4-triazol-4-yl]butan-1-amine CAS Name: 4-[3-[2-(1H-indol-3-yl)ethylthio]-5-(1-naphthalenyl)-1,2,4-triazol-4-yl]-1-butanamine IUPAC Name: 4-[3-[2-(1H-indol-3-yl)ethylsulfanyl]-5-naphthalen-1-yl-1,2,4-triazol-4-yl]butan-1-amine Traditional Name: 4-[3-[2-(1H-indol-3-yl)ethylthio]-5-(1-naphthyl)-1,2,4-triazol-4-yl]butylamine Formula: C26H27N5S MolecularWeight: 441.59108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=NN=C(N3CCCCN)SCCC4=CNC5=CC=CC=C54

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=NN=C(N3CCCCN)SCCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H27N5S/c27-15-5-6-16-31-25(23-12-7-9-19-8-1-2-10-21(19)23)29-30-26(31)32-17-14-20-18-28-24-13-4-3-11-22(20)24/h1-4,7-13,18,28H,5-6,14-17,27H2