N-[4-[2-[(3-ethynylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[4-[2-[(3-ethynylphenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide Openeye Name: N-[4-[2-(3-ethynylanilino)-2-oxo-ethyl]thiazol-2-yl]thiophene-2-carboxamide CAS Name: N-[4-[2-(3-ethynylanilino)-2-oxoethyl]-2-thiazolyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[2-(3-ethynylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide Traditional Name: N-[4-[2-(3-ethynylanilino)-2-keto-ethyl]thiazol-2-yl]thiophene-2-carboxamide Formula: C18H13N3O2S2 MolecularWeight: 367.44472

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)CC2=CSC(=N2)NC(=O)C3=CC=CS3

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)CC2=CSC(=N2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C18H13N3O2S2/c1-2-12-5-3-6-13(9-12)19-16(22)10-14-11-25-18(20-14)21-17(23)15-7-4-8-24-15/h1,3-9,11H,10H2,(H,19,22)(H,20,21,23)