3-(7-chloranyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-prop-2-enyl-benzamide

Systemtic Name: 3-(7-chloranyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-prop-2-enyl-benzamide Openeye Name: N-allyl-3-(7-chloro-4-oxo-2-thioxo-1H-quinazolin-3-yl)benzamide CAS Name: 3-(7-chloro-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-prop-2-enylbenzamide IUPAC Name: 3-(7-chloro-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-prop-2-enylbenzamide Traditional Name: N-allyl-3-(7-chloro-4-keto-2-thioxo-1H-quinazolin-3-yl)benzamide Formula: C18H14ClN3O2S MolecularWeight: 371.84066

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)NC2=S

Isomeric SMILES

C=CCNC(=O)C1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)NC2=S

InChI

InChI=1S/C18H14ClN3O2S/c1-2-8-20-16(23)11-4-3-5-13(9-11)22-17(24)14-7-6-12(19)10-15(14)21-18(22)25/h2-7,9-10H,1,8H2,(H,20,23)(H,21,25)