4-[1-[(7-azanyl-4-oxidanylidene-3,1-benzoxazin-2-yl)oxy]butan-2-yl]cyclohexane-1-carbothialdehyde

Systemtic Name: 4-[1-[(7-azanyl-4-oxidanylidene-3,1-benzoxazin-2-yl)oxy]butan-2-yl]cyclohexane-1-carbothialdehyde Openeye Name: 4-[1-[(7-amino-4-oxo-3,1-benzoxazin-2-yl)oxymethyl]propyl]cyclohexanecarbothialdehyde CAS Name: 4-[1-[(7-amino-4-oxo-3,1-benzoxazin-2-yl)oxy]butan-2-yl]-1-cyclohexanecarbothioaldehyde IUPAC Name: 4-[1-[(7-amino-4-oxo-3,1-benzoxazin-2-yl)oxy]butan-2-yl]cyclohexane-1-carbothialdehyde Traditional Name: 4-[1-[(7-amino-4-keto-3,1-benzoxazin-2-yl)oxymethyl]propyl]cyclohexanecarbothialdehyde Formula: C19H24N2O3S MolecularWeight: 360.47046

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=NC2=C(C=CC(=C2)N)C(=O)O1)C3CCC(CC3)C=S

Isomeric SMILES

CCC(COC1=NC2=C(C=CC(=C2)N)C(=O)O1)C3CCC(CC3)C=S

InChI

InChI=1S/C19H24N2O3S/c1-2-13(14-5-3-12(11-25)4-6-14)10-23-19-21-17-9-15(20)7-8-16(17)18(22)24-19/h7-9,11-14H,2-6,10,20H2,1H3