7-[(3-bromophenyl)carbamoyl]-3-prop-2-enyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 7-[(3-bromophenyl)carbamoyl]-3-prop-2-enyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-allyl-7-[(3-bromophenyl)carbamoyl]-2-thioxo-quinazolin-4-olate CAS Name: 7-[(3-bromoanilino)-oxomethyl]-3-prop-2-enyl-2-sulfanylidene-4-quinazolinolate IUPAC Name: 7-[(3-bromophenyl)carbamoyl]-3-prop-2-enyl-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-allyl-7-[(3-bromophenyl)carbamoyl]-2-thioxo-quinazolin-4-olate Formula: C18H13BrN3O2S- MolecularWeight: 415.28372

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=C2C=CC(=CC2=NC1=S)C(=O)NC3=CC(=CC=C3)Br)[O-]

Isomeric SMILES

C=CCN1C(=C2C=CC(=CC2=NC1=S)C(=O)NC3=CC(=CC=C3)Br)[O-]

InChI

InChI=1S/C18H14BrN3O2S/c1-2-8-22-17(24)14-7-6-11(9-15(14)21-18(22)25)16(23)20-13-5-3-4-12(19)10-13/h2-7,9-10,24H,1,8H2,(H,20,23)/p-1