N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-[1-(2-diethylaminoethyl)-2-benzimidazolyl]-3-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propionamide Formula: C21H29N7O3 MolecularWeight: 427.50006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)CCN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2N=C1NC(=O)CCN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C21H29N7O3/c1-5-25(6-2)13-14-26-18-10-8-7-9-17(18)22-21(26)23-19(29)11-12-27-16(4)20(28(30)31)15(3)24-27/h7-10H,5-6,11-14H2,1-4H3,(H,22,23,29)