4-(azepan-1-yl)quinoline-3-carbothioamide

Systemtic Name: 4-(azepan-1-yl)quinoline-3-carbothioamide Openeye Name: 4-(azepan-1-yl)quinoline-3-carbothioamide CAS Name: 4-(1-azepanyl)-3-quinolinecarbothioamide IUPAC Name: 4-(azepan-1-yl)quinoline-3-carbothioamide Traditional Name: 4-(azepan-1-yl)quinoline-3-carbothioamide Formula: C16H19N3S MolecularWeight: 285.40716

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=NC3=CC=CC=C32)C(=S)N

Isomeric SMILES

C1CCCN(CC1)C2=C(C=NC3=CC=CC=C32)C(=S)N

InChI

InChI=1S/C16H19N3S/c17-16(20)13-11-18-14-8-4-3-7-12(14)15(13)19-9-5-1-2-6-10-19/h3-4,7-8,11H,1-2,5-6,9-10H2,(H2,17,20)