4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5,6,7,8-tetrahydro-1H-quinazolin-2-one

Systemtic Name: 4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5,6,7,8-tetrahydro-1H-quinazolin-2-one Openeye Name: 4-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-5,6,7,8-tetrahydro-1H-quinazolin-2-one CAS Name: 4-[[2-(1-azepanyl)-2-oxoethyl]thio]-5,6,7,8-tetrahydro-1H-quinazolin-2-one IUPAC Name: 4-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-5,6,7,8-tetrahydro-1H-quinazolin-2-one Traditional Name: 4-[[2-(azepan-1-yl)-2-keto-ethyl]thio]-5,6,7,8-tetrahydro-1H-quinazolin-2-one Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CSC2=NC(=O)NC3=C2CCCC3

Isomeric SMILES

C1CCCN(CC1)C(=O)CSC2=NC(=O)NC3=C2CCCC3

InChI

InChI=1S/C16H23N3O2S/c20-14(19-9-5-1-2-6-10-19)11-22-15-12-7-3-4-8-13(12)17-16(21)18-15/h1-11H2,(H,17,18,21)