1-[(E)-[4-(2-phenylethynyl)thiophen-2-yl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[4-(2-phenylethynyl)thiophen-2-yl]methylideneamino]thiourea Openeye Name: [(E)-[4-(2-phenylethynyl)-2-thienyl]methyleneamino]thiourea CAS Name: [(E)-[4-(2-phenylethynyl)-2-thiophenyl]methylideneamino]thiourea IUPAC Name: [(E)-[4-(2-phenylethynyl)thiophen-2-yl]methylideneamino]thiourea Traditional Name: [(E)-[4-(2-phenylethynyl)-2-thienyl]methyleneamino]thiourea Formula: C14H11N3S2 MolecularWeight: 285.38724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CSC(=C2)C=NNC(=S)N

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CSC(=C2)/C=N/NC(=S)N

InChI

InChI=1S/C14H11N3S2/c15-14(18)17-16-9-13-8-12(10-19-13)7-6-11-4-2-1-3-5-11/h1-5,8-10H,(H3,15,17,18)/b16-9+