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

Systemtic Name: N-[2-[3-[bis(azanyl)methylidene]indol-5-yl]ethyl]-4-pyrimidin-5-yl-benzamide Openeye Name: N-[2-[3-(diaminomethylene)indol-5-yl]ethyl]-4-pyrimidin-5-yl-benzamide CAS Name: N-[2-[3-(diaminomethylidene)-5-indolyl]ethyl]-4-(5-pyrimidinyl)benzamide IUPAC Name: N-[2-[3-(diaminomethylidene)indol-5-yl]ethyl]-4-pyrimidin-5-ylbenzamide Traditional Name: N-[2-[3-(diaminomethylene)indol-5-yl]ethyl]-4-(5-pyrimidyl)benzamide Formula: C22H20N6O MolecularWeight: 384.4338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CN=CN=C2)C(=O)NCCC3=CC4=C(C=C3)N=CC4=C(N)N

Isomeric SMILES

C1=CC(=CC=C1C2=CN=CN=C2)C(=O)NCCC3=CC4=C(C=C3)N=CC4=C(N)N

InChI

InChI=1S/C22H20N6O/c23-21(24)19-12-28-20-6-1-14(9-18(19)20)7-8-27-22(29)16-4-2-15(3-5-16)17-10-25-13-26-11-17/h1-6,9-13H,7-8,23-24H2,(H,27,29)