4-[(1-phenylpyrazol-4-yl)methylsulfanyl]aniline

Systemtic Name: 4-[(1-phenylpyrazol-4-yl)methylsulfanyl]aniline Openeye Name: 4-[(1-phenylpyrazol-4-yl)methylsulfanyl]aniline CAS Name: 4-[(1-phenyl-4-pyrazolyl)methylthio]aniline IUPAC Name: 4-[(1-phenylpyrazol-4-yl)methylsulfanyl]aniline Traditional Name: [4-[(1-phenylpyrazol-4-yl)methylthio]phenyl]amine Formula: C16H15N3S MolecularWeight: 281.3754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CSC3=CC=C(C=C3)N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CSC3=CC=C(C=C3)N

InChI

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