(4-hexyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl)-phenyl-methanone

Systemtic Name: (4-hexyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl)-phenyl-methanone Openeye Name: (4-hexyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl)-phenyl-methanone CAS Name: (4-hexyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl)-phenylmethanone IUPAC Name: (4-hexyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl)-phenylmethanone Traditional Name: (4-hexyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl)-phenyl-methanone Formula: C17H22N2OS MolecularWeight: 302.43438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(=CNC(=S)N1)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC1C(=CNC(=S)N1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H22N2OS/c1-2-3-4-8-11-15-14(12-18-17(21)19-15)16(20)13-9-6-5-7-10-13/h5-7,9-10,12,15H,2-4,8,11H2,1H3,(H2,18,19,21)