1-[4-(2-azidoethyl)phenyl]-6-chloranyl-2-ethyl-benzimidazole-5-carboxamide

Systemtic Name: 1-[4-(2-azidoethyl)phenyl]-6-chloranyl-2-ethyl-benzimidazole-5-carboxamide Openeye Name: 1-[4-(2-azidoethyl)phenyl]-6-chloro-2-ethyl-benzimidazole-5-carboxamide CAS Name: 1-[4-(2-azidoethyl)phenyl]-6-chloro-2-ethyl-5-benzimidazolecarboxamide IUPAC Name: 1-[4-(2-azidoethyl)phenyl]-6-chloro-2-ethylbenzimidazole-5-carboxamide Traditional Name: 1-[4-(2-azidoethyl)phenyl]-6-chloro-2-ethyl-benzimidazole-5-carboxamide Formula: C18H17ClN6O MolecularWeight: 368.82018

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=CC=C(C=C3)CCN=[N+]=[N-])C=C(C(=C2)C(=O)N)Cl

Isomeric SMILES

CCC1=NC2=C(N1C3=CC=C(C=C3)CCN=[N+]=[N-])C=C(C(=C2)C(=O)N)Cl

InChI

InChI=1S/C18H17ClN6O/c1-2-17-23-15-9-13(18(20)26)14(19)10-16(15)25(17)12-5-3-11(4-6-12)7-8-22-24-21/h3-6,9-10H,2,7-8H2,1H3,(H2,20,26)