1-benzo[e][1,3]benzothiazol-2-yl-3-[(E)-(4-dimethylaminophenyl)methylideneamino]urea

Systemtic Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-[(E)-(4-dimethylaminophenyl)methylideneamino]urea Openeye Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-[(E)-(4-dimethylaminophenyl)methyleneamino]urea CAS Name: 1-(2-benzo[e][1,3]benzothiazolyl)-3-[(E)-(4-dimethylaminophenyl)methylideneamino]urea IUPAC Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-[(E)-(4-dimethylaminophenyl)methylideneamino]urea Traditional Name: 1-benzo[e][1,3]benzothiazol-2-yl-3-[(E)-[4-(dimethylamino)benzylidene]amino]urea Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=NNC(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=N/NC(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43

InChI

InChI=1S/C21H19N5OS/c1-26(2)16-10-7-14(8-11-16)13-22-25-20(27)24-21-23-19-17-6-4-3-5-15(17)9-12-18(19)28-21/h3-13H,1-2H3,(H2,23,24,25,27)/b22-13+