3-[4-(1H-benzimidazol-2-ylamino)phenyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[4-(1H-benzimidazol-2-ylamino)phenyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[4-(1H-benzimidazol-2-ylamino)phenyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[4-(1H-benzimidazol-2-ylamino)phenyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[4-(1H-benzimidazol-2-ylamino)phenyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[4-(1H-benzimidazol-2-ylamino)phenyl]-2-thioxo-1H-quinazolin-4-one Formula: C21H15N5OS MolecularWeight: 385.4417

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)C3=CC=C(C=C3)NC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)C3=CC=C(C=C3)NC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C21H15N5OS/c27-19-15-5-1-2-6-16(15)25-21(28)26(19)14-11-9-13(10-12-14)22-20-23-17-7-3-4-8-18(17)24-20/h1-12H,(H,25,28)(H2,22,23,24)