1-[(E)-[5-nitro-2-(thiophen-2-ylmethylsulfanyl)phenyl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[5-nitro-2-(thiophen-2-ylmethylsulfanyl)phenyl]methylideneamino]thiourea Openeye Name: [(E)-[5-nitro-2-(2-thienylmethylsulfanyl)phenyl]methyleneamino]thiourea CAS Name: [(E)-[5-nitro-2-(thiophen-2-ylmethylthio)phenyl]methylideneamino]thiourea IUPAC Name: [(E)-[5-nitro-2-(thiophen-2-ylmethylsulfanyl)phenyl]methylideneamino]thiourea Traditional Name: [(E)-[5-nitro-2-(2-thenylthio)benzylidene]amino]thiourea Formula: C13H12N4O2S3 MolecularWeight: 352.45498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CSC2=C(C=C(C=C2)[N+](=O)[O-])C=NNC(=S)N

Isomeric SMILES

C1=CSC(=C1)CSC2=C(C=C(C=C2)[N+](=O)[O-])/C=N/NC(=S)N

InChI

InChI=1S/C13H12N4O2S3/c14-13(20)16-15-7-9-6-10(17(18)19)3-4-12(9)22-8-11-2-1-5-21-11/h1-7H,8H2,(H3,14,16,20)/b15-7+