6-(6-bromanyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-prop-2-enyl-hexanamide

Systemtic Name: 6-(6-bromanyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-prop-2-enyl-hexanamide Openeye Name: N-allyl-6-(6-bromo-4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: 6-(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-prop-2-enylhexanamide IUPAC Name: 6-(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-prop-2-enylhexanamide Traditional Name: N-allyl-6-(6-bromo-4-keto-2-thioxo-1H-quinazolin-3-yl)hexanamide Formula: C17H20BrN3O2S MolecularWeight: 410.3286

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)CCCCCN1C(=O)C2=C(C=CC(=C2)Br)NC1=S

Isomeric SMILES

C=CCNC(=O)CCCCCN1C(=O)C2=C(C=CC(=C2)Br)NC1=S

InChI

InChI=1S/C17H20BrN3O2S/c1-2-9-19-15(22)6-4-3-5-10-21-16(23)13-11-12(18)7-8-14(13)20-17(21)24/h2,7-8,11H,1,3-6,9-10H2,(H,19,22)(H,20,24)