1-[(E)-[2-(1,3-benzoxazol-2-ylsulfanyl)cyclohexen-1-yl]methylideneamino]urea

Systemtic Name: 1-[(E)-[2-(1,3-benzoxazol-2-ylsulfanyl)cyclohexen-1-yl]methylideneamino]urea Openeye Name: [(E)-[2-(1,3-benzoxazol-2-ylsulfanyl)cyclohexen-1-yl]methyleneamino]urea CAS Name: [(E)-[2-(1,3-benzoxazol-2-ylthio)-1-cyclohexenyl]methylideneamino]urea IUPAC Name: [(E)-[2-(1,3-benzoxazol-2-ylsulfanyl)cyclohexen-1-yl]methylideneamino]urea Traditional Name: [(E)-[2-(1,3-benzoxazol-2-ylthio)cyclohexen-1-yl]methyleneamino]urea Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=C(C1)C=NNC(=O)N)SC2=NC3=CC=CC=C3O2

Isomeric SMILES

C1CCC(=C(C1)/C=N/NC(=O)N)SC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C15H16N4O2S/c16-14(20)19-17-9-10-5-1-4-8-13(10)22-15-18-11-6-2-3-7-12(11)21-15/h2-3,6-7,9H,1,4-5,8H2,(H3,16,19,20)/b17-9+