N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-3-(3-methylindol-1-yl)propanamide

Systemtic Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-3-(3-methylindol-1-yl)propanamide Openeye Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-3-(3-methylindol-1-yl)propanamide CAS Name: N-[1-(1-benzotriazolylmethyl)-4-pyrazolyl]-3-(3-methyl-1-indolyl)propanamide IUPAC Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-3-(3-methylindol-1-yl)propanamide Traditional Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-3-(3-methylindol-1-yl)propionamide Formula: C22H21N7O MolecularWeight: 399.44844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=CC=CC=C12)CCC(=O)NC3=CN(N=C3)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=CN(C2=CC=CC=C12)CCC(=O)NC3=CN(N=C3)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C22H21N7O/c1-16-13-27(20-8-4-2-6-18(16)20)11-10-22(30)24-17-12-23-28(14-17)15-29-21-9-5-3-7-19(21)25-26-29/h2-9,12-14H,10-11,15H2,1H3,(H,24,30)