[2-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 4-methyl-N-phenyl-piperazine-1-carboximidothioate

Systemtic Name: [2-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 4-methyl-N-phenyl-piperazine-1-carboximidothioate Openeye Name: [2-[(4-tert-butylthiazol-2-yl)amino]-2-oxo-ethyl] 4-methyl-N-phenyl-piperazine-1-carboximidothioate CAS Name: 4-methyl-N-phenyl-1-piperazinecarboximidothioic acid [2-[(4-tert-butyl-2-thiazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-2-oxoethyl] 4-methyl-N-phenylpiperazine-1-carboximidothioate Traditional Name: 4-methyl-N-phenyl-piperazine-1-carboximidothioic acid [2-[(4-tert-butylthiazol-2-yl)amino]-2-keto-ethyl] ester Formula: C21H29N5OS2 MolecularWeight: 431.61786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)CSC(=NC2=CC=CC=C2)N3CCN(CC3)C

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)CSC(=NC2=CC=CC=C2)N3CCN(CC3)C

InChI

InChI=1S/C21H29N5OS2/c1-21(2,3)17-14-28-19(23-17)24-18(27)15-29-20(22-16-8-6-5-7-9-16)26-12-10-25(4)11-13-26/h5-9,14H,10-13,15H2,1-4H3,(H,23,24,27)