N-[(1S)-1-(benzotriazol-1-yl)-2-phenyl-ethyl]-4-methyl-benzamide

Systemtic Name: N-[(1S)-1-(benzotriazol-1-yl)-2-phenyl-ethyl]-4-methyl-benzamide Openeye Name: N-[(1S)-1-(benzotriazol-1-yl)-2-phenyl-ethyl]-4-methyl-benzamide CAS Name: N-[(1S)-1-(1-benzotriazolyl)-2-phenylethyl]-4-methylbenzamide IUPAC Name: N-[(1S)-1-(benzotriazol-1-yl)-2-phenylethyl]-4-methylbenzamide Traditional Name: N-[(1S)-1-(benzotriazol-1-yl)-2-phenyl-ethyl]-4-methyl-benzamide Formula: C22H20N4O MolecularWeight: 356.4204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(CC2=CC=CC=C2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@H](CC2=CC=CC=C2)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C22H20N4O/c1-16-11-13-18(14-12-16)22(27)23-21(15-17-7-3-2-4-8-17)26-20-10-6-5-9-19(20)24-25-26/h2-14,21H,15H2,1H3,(H,23,27)/t21-/m0/s1