4-oxidanylidene-N-(1-phenylbenzimidazol-2-yl)-1H-quinazoline-2-carbothioamide

Systemtic Name: 4-oxidanylidene-N-(1-phenylbenzimidazol-2-yl)-1H-quinazoline-2-carbothioamide Openeye Name: 4-oxo-N-(1-phenylbenzimidazol-2-yl)-1H-quinazoline-2-carbothioamide CAS Name: 4-oxo-N-(1-phenyl-2-benzimidazolyl)-1H-quinazoline-2-carbothioamide IUPAC Name: 4-oxo-N-(1-phenylbenzimidazol-2-yl)-1H-quinazoline-2-carbothioamide Traditional Name: 4-keto-N-(1-phenylbenzimidazol-2-yl)-1H-quinazoline-2-carbothioamide Formula: C22H15N5OS MolecularWeight: 397.4524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=CC=CC=C3N=C2NC(=S)C4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)N2C3=CC=CC=C3N=C2NC(=S)C4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C22H15N5OS/c28-20-15-10-4-5-11-16(15)23-19(25-20)21(29)26-22-24-17-12-6-7-13-18(17)27(22)14-8-2-1-3-9-14/h1-13H,(H,23,25,28)(H,24,26,29)