3-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-[(pyrazin-2-ylamino)methyl]quinazolin-4-one

Systemtic Name: 3-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-[(pyrazin-2-ylamino)methyl]quinazolin-4-one Openeye Name: 3-[4-(4-chlorophenyl)thiazol-2-yl]-2-[(pyrazin-2-ylamino)methyl]quinazolin-4-one CAS Name: 3-[4-(4-chlorophenyl)-2-thiazolyl]-2-[(2-pyrazinylamino)methyl]-4-quinazolinone IUPAC Name: 3-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-[(pyrazin-2-ylamino)methyl]quinazolin-4-one Traditional Name: 3-[4-(4-chlorophenyl)thiazol-2-yl]-2-[(pyrazin-2-ylamino)methyl]quinazolin-4-one Formula: C22H15ClN6OS MolecularWeight: 446.9121

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)CNC3=NC=CN=C3)C4=NC(=CS4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)CNC3=NC=CN=C3)C4=NC(=CS4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C22H15ClN6OS/c23-15-7-5-14(6-8-15)18-13-31-22(28-18)29-20(12-26-19-11-24-9-10-25-19)27-17-4-2-1-3-16(17)21(29)30/h1-11,13H,12H2,(H,25,26)