tert-butyl 3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-2-thiophen-2-yl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxylate

Systemtic Name: tert-butyl 3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-2-thiophen-2-yl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxylate Openeye Name: tert-butyl 3-(2-anilino-2-oxo-ethyl)sulfanyl-2-(2-thienyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxylate CAS Name: 3-[(2-anilino-2-oxoethyl)thio]-2-thiophen-2-yl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-anilino-2-oxoethyl)sulfanyl-2-thiophen-2-yl-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxylate Traditional Name: 3-[(2-anilino-2-keto-ethyl)thio]-2-(2-thienyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxylic acid tert-butyl ester Formula: C24H28N4O3S2 MolecularWeight: 484.63412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2(CC1)N=C(C(=N2)SCC(=O)NC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2(CC1)N=C(C(=N2)SCC(=O)NC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C24H28N4O3S2/c1-23(2,3)31-22(30)28-13-11-24(12-14-28)26-20(18-10-7-15-32-18)21(27-24)33-16-19(29)25-17-8-5-4-6-9-17/h4-10,15H,11-14,16H2,1-3H3,(H,25,29)