3-(2-fluorophenyl)-4-oxidanylidene-N-(phenylmethyl)-N-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(2-fluorophenyl)-4-oxidanylidene-N-(phenylmethyl)-N-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-benzyl-3-(2-fluorophenyl)-4-oxo-N-propyl-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(2-fluorophenyl)-4-oxo-N-(phenylmethyl)-N-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-benzyl-3-(2-fluorophenyl)-4-oxo-N-propyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-benzyl-3-(2-fluorophenyl)-4-keto-N-propyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C25H22FN3O2S MolecularWeight: 447.524483

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC=C4F

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC=C4F

InChI

InChI=1S/C25H22FN3O2S/c1-2-14-28(16-17-8-4-3-5-9-17)23(30)18-12-13-19-21(15-18)27-25(32)29(24(19)31)22-11-7-6-10-20(22)26/h3-13,15H,2,14,16H2,1H3,(H,27,32)