2-[(3-methylbenzotriazol-5-yl)methyl]-3-(1,2,4-triazol-1-ylmethyl)benzenecarbonitrile

Systemtic Name: 2-[(3-methylbenzotriazol-5-yl)methyl]-3-(1,2,4-triazol-1-ylmethyl)benzenecarbonitrile Openeye Name: 2-[(3-methylbenzotriazol-5-yl)methyl]-3-(1,2,4-triazol-1-ylmethyl)benzonitrile CAS Name: 2-[(3-methyl-5-benzotriazolyl)methyl]-3-(1,2,4-triazol-1-ylmethyl)benzonitrile IUPAC Name: 2-[(3-methylbenzotriazol-5-yl)methyl]-3-(1,2,4-triazol-1-ylmethyl)benzonitrile Traditional Name: 2-[(3-methylbenzotriazol-5-yl)methyl]-3-(1,2,4-triazol-1-ylmethyl)benzonitrile Formula: C18H15N7 MolecularWeight: 329.3586

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)CC3=C(C=CC=C3CN4C=NC=N4)C#N)N=N1

Isomeric SMILES

CN1C2=C(C=CC(=C2)CC3=C(C=CC=C3CN4C=NC=N4)C#N)N=N1

InChI

InChI=1S/C18H15N7/c1-24-18-8-13(5-6-17(18)22-23-24)7-16-14(9-19)3-2-4-15(16)10-25-12-20-11-21-25/h2-6,8,11-12H,7,10H2,1H3