N-[2-[3-[bis(azanyl)methylidene]indol-5-yl]ethyl]-4-imidazol-1-yl-benzamide

Systemtic Name: N-[2-[3-[bis(azanyl)methylidene]indol-5-yl]ethyl]-4-imidazol-1-yl-benzamide Openeye Name: N-[2-[3-(diaminomethylene)indol-5-yl]ethyl]-4-imidazol-1-yl-benzamide CAS Name: N-[2-[3-(diaminomethylidene)-5-indolyl]ethyl]-4-(1-imidazolyl)benzamide IUPAC Name: N-[2-[3-(diaminomethylidene)indol-5-yl]ethyl]-4-imidazol-1-ylbenzamide Traditional Name: N-[2-[3-(diaminomethylene)indol-5-yl]ethyl]-4-imidazol-1-yl-benzamide Formula: C21H20N6O MolecularWeight: 372.4231

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCC2=CC3=C(C=C2)N=CC3=C(N)N)N4C=CN=C4

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCC2=CC3=C(C=C2)N=CC3=C(N)N)N4C=CN=C4

InChI

InChI=1S/C21H20N6O/c22-20(23)18-12-26-19-6-1-14(11-17(18)19)7-8-25-21(28)15-2-4-16(5-3-15)27-10-9-24-13-27/h1-6,9-13H,7-8,22-23H2,(H,25,28)