[2-(butylamino)-2-oxidanylidene-ethyl] 2-phenylazanylthieno[2,3-d][1,3]thiazole-5-carboxylate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 2-phenylazanylthieno[2,3-d][1,3]thiazole-5-carboxylate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 2-anilinothieno[2,3-d]thiazole-5-carboxylate CAS Name: 2-anilino-5-thieno[2,3-d]thiazolecarboxylic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 2-anilinothieno[2,3-d][1,3]thiazole-5-carboxylate Traditional Name: 2-anilinothieno[2,3-d]thiazole-5-carboxylic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C18H19N3O3S2 MolecularWeight: 389.49176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=CC2=C(S1)N=C(S2)NC3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=CC2=C(S1)N=C(S2)NC3=CC=CC=C3

InChI

InChI=1S/C18H19N3O3S2/c1-2-3-9-19-15(22)11-24-17(23)14-10-13-16(25-14)21-18(26-13)20-12-7-5-4-6-8-12/h4-8,10H,2-3,9,11H2,1H3,(H,19,22)(H,20,21)