3-[4-methyl-5-(2-phenylquinazolin-4-yl)sulfanyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-methyl-5-(2-phenylquinazolin-4-yl)sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-methyl-5-(2-phenylquinazolin-4-yl)sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-methyl-5-[(2-phenyl-4-quinazolinyl)thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-methyl-5-(2-phenylquinazolin-4-yl)sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-methyl-5-[(2-phenylquinazolin-4-yl)thio]-1,2,4-triazol-3-yl]propionamide Formula: C20H18N6OS MolecularWeight: 390.46152

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4)CCC(=O)N

Isomeric SMILES

CN1C(=NN=C1SC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4)CCC(=O)N

InChI

InChI=1S/C20H18N6OS/c1-26-17(12-11-16(21)27)24-25-20(26)28-19-14-9-5-6-10-15(14)22-18(23-19)13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H2,21,27)