1-(6-chloranyl-1,3-benzothiazol-2-yl)-3-[(E)-(4-dimethylaminophenyl)methylideneamino]thiourea

Systemtic Name: 1-(6-chloranyl-1,3-benzothiazol-2-yl)-3-[(E)-(4-dimethylaminophenyl)methylideneamino]thiourea Openeye Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-3-[(E)-(4-dimethylaminophenyl)methyleneamino]thiourea CAS Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-3-[(E)-(4-dimethylaminophenyl)methylideneamino]thiourea IUPAC Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-3-[(E)-(4-dimethylaminophenyl)methylideneamino]thiourea Traditional Name: 1-(6-chloro-1,3-benzothiazol-2-yl)-3-[(E)-[4-(dimethylamino)benzylidene]amino]thiourea Formula: C17H16ClN5S2 MolecularWeight: 389.92544

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=NNC(=S)NC2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=N/NC(=S)NC2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C17H16ClN5S2/c1-23(2)13-6-3-11(4-7-13)10-19-22-16(24)21-17-20-14-8-5-12(18)9-15(14)25-17/h3-10H,1-2H3,(H2,20,21,22,24)/b19-10+