N-[(2S)-1-(cyclohexylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]benzotriazole-1-carboxamide

Systemtic Name: N-[(2S)-1-(cyclohexylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]benzotriazole-1-carboxamide Openeye Name: N-[(1S)-1-(cyclohexylcarbamoyl)-3-methyl-butyl]benzotriazole-1-carboxamide CAS Name: N-[(2S)-1-(cyclohexylamino)-4-methyl-1-oxopentan-2-yl]-1-benzotriazolecarboxamide IUPAC Name: N-[(2S)-1-(cyclohexylamino)-4-methyl-1-oxopentan-2-yl]benzotriazole-1-carboxamide Traditional Name: N-[(1S)-1-(cyclohexylcarbamoyl)-3-methyl-butyl]benzotriazole-1-carboxamide Formula: C19H27N5O2 MolecularWeight: 357.44998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1CCCCC1)NC(=O)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC1CCCCC1)NC(=O)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C19H27N5O2/c1-13(2)12-16(18(25)20-14-8-4-3-5-9-14)21-19(26)24-17-11-7-6-10-15(17)22-23-24/h6-7,10-11,13-14,16H,3-5,8-9,12H2,1-2H3,(H,20,25)(H,21,26)/t16-/m0/s1