2-(benzotriazol-1-yl)-2-ethoxy-N-phenyl-but-3-enethioamide

Systemtic Name: 2-(benzotriazol-1-yl)-2-ethoxy-N-phenyl-but-3-enethioamide Openeye Name: 2-(benzotriazol-1-yl)-2-ethoxy-N-phenyl-but-3-enethioamide CAS Name: 2-(1-benzotriazolyl)-2-ethoxy-N-phenyl-3-butenethioamide IUPAC Name: 2-(benzotriazol-1-yl)-2-ethoxy-N-phenylbut-3-enethioamide Traditional Name: 2-(benzotriazol-1-yl)-2-ethoxy-N-phenyl-but-3-enethioamide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C=C)(C(=S)NC1=CC=CC=C1)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCOC(C=C)(C(=S)NC1=CC=CC=C1)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H18N4OS/c1-3-18(23-4-2,17(24)19-14-10-6-5-7-11-14)22-16-13-9-8-12-15(16)20-21-22/h3,5-13H,1,4H2,2H3,(H,19,24)