N-[2-[[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]amino]-2-oxidanylidene-ethyl]-3-methyl-benzamide

Systemtic Name: N-[2-[[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]amino]-2-oxidanylidene-ethyl]-3-methyl-benzamide Openeye Name: N-[2-[[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]amino]-2-oxo-ethyl]-3-methyl-benzamide CAS Name: N-[2-[[(1S)-1-[4-(1-imidazolyl)phenyl]ethyl]amino]-2-oxoethyl]-3-methylbenzamide IUPAC Name: N-[2-[[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]amino]-2-oxoethyl]-3-methylbenzamide Traditional Name: N-[2-[[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]amino]-2-keto-ethyl]-3-methyl-benzamide Formula: C21H22N4O2 MolecularWeight: 362.42498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC(=O)NC(C)C2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC(=O)N[C@@H](C)C2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C21H22N4O2/c1-15-4-3-5-18(12-15)21(27)23-13-20(26)24-16(2)17-6-8-19(9-7-17)25-11-10-22-14-25/h3-12,14,16H,13H2,1-2H3,(H,23,27)(H,24,26)/t16-/m0/s1