3-[6,7-bis(chloranyl)-3-propan-2-yl-quinoxalin-2-yl]sulfanyl-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[6,7-bis(chloranyl)-3-propan-2-yl-quinoxalin-2-yl]sulfanyl-1H-1,2,4-triazol-5-amine Openeye Name: 3-(6,7-dichloro-3-isopropyl-quinoxalin-2-yl)sulfanyl-1H-1,2,4-triazol-5-amine CAS Name: 3-[(6,7-dichloro-3-propan-2-yl-2-quinoxalinyl)thio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-(6,7-dichloro-3-propan-2-ylquinoxalin-2-yl)sulfanyl-1H-1,2,4-triazol-5-amine Traditional Name: [3-[(6,7-dichloro-3-isopropyl-quinoxalin-2-yl)thio]-1H-1,2,4-triazol-5-yl]amine Formula: C13H12Cl2N6S MolecularWeight: 355.24558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC(=C(C=C2N=C1SC3=NNC(=N3)N)Cl)Cl

Isomeric SMILES

CC(C)C1=NC2=CC(=C(C=C2N=C1SC3=NNC(=N3)N)Cl)Cl

InChI

InChI=1S/C13H12Cl2N6S/c1-5(2)10-11(22-13-19-12(16)20-21-13)18-9-4-7(15)6(14)3-8(9)17-10/h3-5H,1-2H3,(H3,16,19,20,21)