2,6-bis(azanyl)-8-[(3-phenylphenyl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2,6-bis(azanyl)-8-[(3-phenylphenyl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2,6-diamino-8-[(3-phenylphenyl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2,6-diamino-8-[[(3-phenylphenyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2,6-diamino-8-[(3-phenylphenyl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2,6-diamino-8-[[(3-phenylphenyl)thio]methyl]-1H-quinazolin-4-one Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC=C2)SCC3=C4C(=CC(=C3)N)C(=O)N=C(N4)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC=C2)SCC3=C4C(=CC(=C3)N)C(=O)N=C(N4)N

InChI

InChI=1S/C21H18N4OS/c22-16-9-15(19-18(11-16)20(26)25-21(23)24-19)12-27-17-8-4-7-14(10-17)13-5-2-1-3-6-13/h1-11H,12,22H2,(H3,23,24,25,26)