2-(benzotriazol-1-yl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]ethanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]ethanamide Openeye Name: 2-(benzotriazol-1-yl)-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]acetamide CAS Name: 2-(1-benzotriazolyl)-N-[(2S)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]acetamide IUPAC Name: 2-(benzotriazol-1-yl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]acetamide Traditional Name: 2-(benzotriazol-1-yl)-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]acetamide Formula: C18H21N5O2S MolecularWeight: 371.45664

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(CNC(=O)CN2C3=CC=CC=C3N=N2)C4=CC=CS4

Isomeric SMILES

C1COCCN1[C@@H](CNC(=O)CN2C3=CC=CC=C3N=N2)C4=CC=CS4

InChI

InChI=1S/C18H21N5O2S/c24-18(13-23-15-5-2-1-4-14(15)20-21-23)19-12-16(17-6-3-11-26-17)22-7-9-25-10-8-22/h1-6,11,16H,7-10,12-13H2,(H,19,24)/t16-/m0/s1