N-(3-chloranyl-2-imidazol-1-yl-phenyl)thian-4-amine

Systemtic Name: N-(3-chloranyl-2-imidazol-1-yl-phenyl)thian-4-amine Openeye Name: N-(3-chloro-2-imidazol-1-yl-phenyl)tetrahydrothiopyran-4-amine CAS Name: N-[3-chloro-2-(1-imidazolyl)phenyl]-4-thianamine IUPAC Name: N-(3-chloro-2-imidazol-1-ylphenyl)thian-4-amine Traditional Name: (3-chloro-2-imidazol-1-yl-phenyl)-tetrahydrothiopyran-4-yl-amine Formula: C14H16ClN3S MolecularWeight: 293.81494

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1NC2=C(C(=CC=C2)Cl)N3C=CN=C3

Isomeric SMILES

C1CSCCC1NC2=C(C(=CC=C2)Cl)N3C=CN=C3

InChI

InChI=1S/C14H16ClN3S/c15-12-2-1-3-13(14(12)18-7-6-16-10-18)17-11-4-8-19-9-5-11/h1-3,6-7,10-11,17H,4-5,8-9H2