4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]aniline

Systemtic Name: 4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]aniline Openeye Name: 4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]aniline CAS Name: 4-[3-(1H-benzimidazol-2-ylthio)propoxy]aniline IUPAC Name: 4-[3-(1H-benzimidazol-2-ylsulfanyl)propoxy]aniline Traditional Name: [4-[3-(1H-benzimidazol-2-ylthio)propoxy]phenyl]amine Formula: C16H17N3OS MolecularWeight: 299.39068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCCCOC3=CC=C(C=C3)N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCCCOC3=CC=C(C=C3)N

InChI

InChI=1S/C16H17N3OS/c17-12-6-8-13(9-7-12)20-10-3-11-21-16-18-14-4-1-2-5-15(14)19-16/h1-2,4-9H,3,10-11,17H2,(H,18,19)