4-[4-chloranyl-2-(1,2,4-triazol-1-ylmethyl)phenoxy]-N2-ethyl-benzene-1,2-diamine

Systemtic Name: 4-[4-chloranyl-2-(1,2,4-triazol-1-ylmethyl)phenoxy]-N2-ethyl-benzene-1,2-diamine Openeye Name: 4-[4-chloro-2-(1,2,4-triazol-1-ylmethyl)phenoxy]-N2-ethyl-benzene-1,2-diamine CAS Name: 4-[4-chloro-2-(1,2,4-triazol-1-ylmethyl)phenoxy]-N2-ethylbenzene-1,2-diamine IUPAC Name: 4-[4-chloro-2-(1,2,4-triazol-1-ylmethyl)phenoxy]-2-N-ethylbenzene-1,2-diamine Traditional Name: [2-amino-5-[4-chloro-2-(1,2,4-triazol-1-ylmethyl)phenoxy]phenyl]-ethyl-amine Formula: C17H18ClN5O MolecularWeight: 343.81072

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=CC(=C1)OC2=C(C=C(C=C2)Cl)CN3C=NC=N3)N

Isomeric SMILES

CCNC1=C(C=CC(=C1)OC2=C(C=C(C=C2)Cl)CN3C=NC=N3)N

InChI

InChI=1S/C17H18ClN5O/c1-2-21-16-8-14(4-5-15(16)19)24-17-6-3-13(18)7-12(17)9-23-11-20-10-22-23/h3-8,10-11,21H,2,9,19H2,1H3