6-(2-chlorophenyl)-4,4-dimethyl-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-amine

Systemtic Name: 6-(2-chlorophenyl)-4,4-dimethyl-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-amine Openeye Name: 6-(2-chlorophenyl)-4,4-dimethyl-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-amine CAS Name: 6-(2-chlorophenyl)-4,4-dimethyl-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-amine IUPAC Name: 6-(2-chlorophenyl)-4,4-dimethyl-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-amine Traditional Name: [6-(2-chlorophenyl)-4,4-dimethyl-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-8-yl]amine Formula: C18H16ClN5 MolecularWeight: 337.80614

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=NN=CN2C3=C(C=C(C=C3)N)C(=N1)C4=CC=CC=C4Cl)C

Isomeric SMILES

CC1(C2=NN=CN2C3=C(C=C(C=C3)N)C(=N1)C4=CC=CC=C4Cl)C

InChI

InChI=1S/C18H16ClN5/c1-18(2)17-23-21-10-24(17)15-8-7-11(20)9-13(15)16(22-18)12-5-3-4-6-14(12)19/h3-10H,20H2,1-2H3