1-[(E)-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)thiophen-2-yl]methylideneamino]urea

Systemtic Name: 1-[(E)-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)thiophen-2-yl]methylideneamino]urea Openeye Name: [(E)-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-thienyl]methyleneamino]urea CAS Name: [(E)-[4-[(1,3-benzothiazol-2-ylthio)methyl]-2-thiophenyl]methylideneamino]urea IUPAC Name: [(E)-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)thiophen-2-yl]methylideneamino]urea Traditional Name: [(E)-[4-[(1,3-benzothiazol-2-ylthio)methyl]-2-thienyl]methyleneamino]urea Formula: C14H12N4OS3 MolecularWeight: 348.46628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC3=CSC(=C3)C=NNC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC3=CSC(=C3)/C=N/NC(=O)N

InChI

InChI=1S/C14H12N4OS3/c15-13(19)18-16-6-10-5-9(7-20-10)8-21-14-17-11-3-1-2-4-12(11)22-14/h1-7H,8H2,(H3,15,18,19)/b16-6+