1-(3-ethynylphenyl)-3-[(3-ethynylphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-(3-ethynylphenyl)-3-[(3-ethynylphenyl)carbamothioylamino]thiourea Openeye Name: 1-(3-ethynylphenyl)-3-[(3-ethynylphenyl)carbamothioylamino]thiourea CAS Name: 1-[[(3-ethynylanilino)-sulfanylidenemethyl]amino]-3-(3-ethynylphenyl)thiourea IUPAC Name: 1-(3-ethynylphenyl)-3-[(3-ethynylphenyl)carbamothioylamino]thiourea Traditional Name: 1-(3-ethynylphenyl)-3-[(3-ethynylphenyl)thiocarbamoylamino]thiourea Formula: C18H14N4S2 MolecularWeight: 350.46056

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=S)NNC(=S)NC2=CC=CC(=C2)C#C

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=S)NNC(=S)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C18H14N4S2/c1-3-13-7-5-9-15(11-13)19-17(23)21-22-18(24)20-16-10-6-8-14(4-2)12-16/h1-2,5-12H,(H2,19,21,23)(H2,20,22,24)