3-[(E)-butan-2-ylideneamino]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[(E)-butan-2-ylideneamino]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[(E)-1-methylpropylideneamino]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(E)-butan-2-ylideneamino]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[(E)-butan-2-ylideneamino]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[(E)-1-methylpropylideneamino]-2-thioxo-1H-quinazolin-4-one Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NN1C(=O)C2=CC=CC=C2NC1=S)C

Isomeric SMILES

CC/C(=N/N1C(=O)C2=CC=CC=C2NC1=S)/C

InChI

InChI=1S/C12H13N3OS/c1-3-8(2)14-15-11(16)9-6-4-5-7-10(9)13-12(15)17/h4-7H,3H2,1-2H3,(H,13,17)/b14-8+