azepan-1-yl-(3,4,5-trimethoxyphenyl)methanethione

Systemtic Name: azepan-1-yl-(3,4,5-trimethoxyphenyl)methanethione Openeye Name: azepan-1-yl-(3,4,5-trimethoxyphenyl)methanethione CAS Name: 1-azepanyl-(3,4,5-trimethoxyphenyl)methanethione IUPAC Name: azepan-1-yl-(3,4,5-trimethoxyphenyl)methanethione Traditional Name: azepan-1-yl-(3,4,5-trimethoxyphenyl)methanethione Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=S)N2CCCCCC2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=S)N2CCCCCC2

InChI

InChI=1S/C16H23NO3S/c1-18-13-10-12(11-14(19-2)15(13)20-3)16(21)17-8-6-4-5-7-9-17/h10-11H,4-9H2,1-3H3