2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]aniline

Systemtic Name: 2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]aniline Openeye Name: 2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]aniline CAS Name: 2-[[4-(1-pyrazolyl)phenyl]methylthio]aniline IUPAC Name: 2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]aniline Traditional Name: [2-[(4-pyrazol-1-ylbenzyl)thio]phenyl]amine Formula: C16H15N3S MolecularWeight: 281.3754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)SCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

C1=CC=C(C(=C1)N)SCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C16H15N3S/c17-15-4-1-2-5-16(15)20-12-13-6-8-14(9-7-13)19-11-3-10-18-19/h1-11H,12,17H2