4-(benzotriazol-1-ylmethyl)-N-[(1R)-2-methyl-1-thiophen-2-yl-propyl]benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-[(1R)-2-methyl-1-thiophen-2-yl-propyl]benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[(1R)-2-methyl-1-(2-thienyl)propyl]benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[(1R)-2-methyl-1-thiophen-2-ylpropyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-[(1R)-2-methyl-1-thiophen-2-ylpropyl]benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-[(1R)-2-methyl-1-(2-thienyl)propyl]benzamide Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

CC(C)[C@H](C1=CC=CS1)NC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C22H22N4OS/c1-15(2)21(20-8-5-13-28-20)23-22(27)17-11-9-16(10-12-17)14-26-19-7-4-3-6-18(19)24-25-26/h3-13,15,21H,14H2,1-2H3,(H,23,27)/t21-/m1/s1