4-(benzotriazol-1-ylmethyl)-N-[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl]benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-[(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl]benzamide Formula: C19H21N5O2 MolecularWeight: 351.40234

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C19H21N5O2/c1-3-20-18(25)13(2)21-19(26)15-10-8-14(9-11-15)12-24-17-7-5-4-6-16(17)22-23-24/h4-11,13H,3,12H2,1-2H3,(H,20,25)(H,21,26)/t13-/m0/s1