N-(3-pyrrol-1-ylphenyl)thian-4-amine

Systemtic Name: N-(3-pyrrol-1-ylphenyl)thian-4-amine Openeye Name: N-(3-pyrrol-1-ylphenyl)tetrahydrothiopyran-4-amine CAS Name: N-[3-(1-pyrrolyl)phenyl]-4-thianamine IUPAC Name: N-(3-pyrrol-1-ylphenyl)thian-4-amine Traditional Name: (3-pyrrol-1-ylphenyl)-tetrahydrothiopyran-4-yl-amine Formula: C15H18N2S MolecularWeight: 258.38182

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCC1NC2=CC=CC(=C2)N3C=CC=C3

Isomeric SMILES

C1CSCCC1NC2=CC=CC(=C2)N3C=CC=C3

InChI

InChI=1S/C15H18N2S/c1-2-9-17(8-1)15-5-3-4-14(12-15)16-13-6-10-18-11-7-13/h1-5,8-9,12-13,16H,6-7,10-11H2