N-cycloheptyl-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide

Systemtic Name: N-cycloheptyl-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Openeye Name: N-cycloheptyl-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-cycloheptyl-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide IUPAC Name: N-cycloheptyl-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Traditional Name: N-cycloheptyl-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

C1CCCC(CC1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C21H29N3O2S/c25-19(22-16-10-4-1-2-5-11-16)14-6-3-9-15-24-20(26)17-12-7-8-13-18(17)23-21(24)27/h7-8,12-13,16H,1-6,9-11,14-15H2,(H,22,25)(H,23,27)