1-(7-oxidanylidene-5,6-dihydro-4H-1-benzothiophen-4-yl)-3-prop-2-ynyl-thiourea

Systemtic Name: 1-(7-oxidanylidene-5,6-dihydro-4H-1-benzothiophen-4-yl)-3-prop-2-ynyl-thiourea Openeye Name: 1-(7-oxo-5,6-dihydro-4H-benzothiophen-4-yl)-3-prop-2-ynyl-thiourea CAS Name: 1-(7-oxo-5,6-dihydro-4H-1-benzothiophen-4-yl)-3-prop-2-ynylthiourea IUPAC Name: 1-(7-oxo-5,6-dihydro-4H-1-benzothiophen-4-yl)-3-prop-2-ynylthiourea Traditional Name: 1-(7-keto-5,6-dihydro-4H-benzothiophen-4-yl)-3-propargyl-thiourea Formula: C12H12N2OS2 MolecularWeight: 264.36648

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=S)NC1CCC(=O)C2=C1C=CS2

Isomeric SMILES

C#CCNC(=S)NC1CCC(=O)C2=C1C=CS2

InChI

InChI=1S/C12H12N2OS2/c1-2-6-13-12(16)14-9-3-4-10(15)11-8(9)5-7-17-11/h1,5,7,9H,3-4,6H2,(H2,13,14,16)