N-[2-(cyclohexen-1-yl)ethyl]-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]propionamide Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CCCCC1)SC2=NC3=CC=CC=C3C(=O)N2C

Isomeric SMILES

CC(C(=O)NCCC1=CCCCC1)SC2=NC3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C20H25N3O2S/c1-14(18(24)21-13-12-15-8-4-3-5-9-15)26-20-22-17-11-7-6-10-16(17)19(25)23(20)2/h6-8,10-11,14H,3-5,9,12-13H2,1-2H3,(H,21,24)