prop-2-ynyl N'-[(phenylmethylidene)amino]carbamimidothioate

Systemtic Name: prop-2-ynyl N'-[(phenylmethylidene)amino]carbamimidothioate Openeye Name: 3-(benzylideneamino)-2-prop-2-ynyl-isothiourea CAS Name: N'-[(phenylmethylene)amino]carbamimidothioic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl N'-(benzylideneamino)carbamimidothioate Traditional Name: 3-(benzalamino)-2-propargyl-isothiourea Formula: C11H11N3S MolecularWeight: 217.29014

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Descriptors Computed from Structure

Canonical SMILES:

C#CCSC(=NN=CC1=CC=CC=C1)N

Isomeric SMILES

C#CCSC(=NN=CC1=CC=CC=C1)N

InChI

InChI=1S/C11H11N3S/c1-2-8-15-11(12)14-13-9-10-6-4-3-5-7-10/h1,3-7,9H,8H2,(H2,12,14)