2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]propanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]propanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-[2-(benzotriazol-1-yl)-1-methyl-ethylidene]amino]propanamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-1-(1-benzotriazolyl)propan-2-ylideneamino]propanamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]propanamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(E)-[2-(benzotriazol-1-yl)-1-methyl-ethylidene]amino]propionamide Formula: C19H18N6OS2 MolecularWeight: 410.51582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=C(C)CN1C2=CC=CC=C2N=N1)SC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C(=O)N/N=C(\C)/CN1C2=CC=CC=C2N=N1)SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H18N6OS2/c1-12(11-25-16-9-5-3-7-14(16)22-24-25)21-23-18(26)13(2)27-19-20-15-8-4-6-10-17(15)28-19/h3-10,13H,11H2,1-2H3,(H,23,26)/b21-12+