N'-[3-[4-(6-methyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]butanediamide

Systemtic Name: N'-[3-[4-(6-methyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]butanediamide Openeye Name: N'-[3-[4-(6-methyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]butanediamide CAS Name: N'-[3-[4-(6-methyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]butanediamide IUPAC Name: N'-[3-[4-(6-methyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]butanediamide Traditional Name: N'-[3-[4-(6-methyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]succinamide Formula: C21H19N5O3 MolecularWeight: 389.40726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C3=C(NN=C3)C4=CC(=CC=C4)NC(=O)CCC(=O)N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)C3=C(NN=C3)C4=CC(=CC=C4)NC(=O)CCC(=O)N

InChI

InChI=1S/C21H19N5O3/c1-12-5-6-16-17(9-12)29-21(25-16)15-11-23-26-20(15)13-3-2-4-14(10-13)24-19(28)8-7-18(22)27/h2-6,9-11H,7-8H2,1H3,(H2,22,27)(H,23,26)(H,24,28)