ethyl 2-[2-[[3-(cyclohexylcarbonylamino)phenyl]carbonylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[[3-(cyclohexylcarbonylamino)phenyl]carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[3-(cyclohexanecarbonylamino)benzoyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[[3-[[cyclohexyl(oxo)methyl]amino]phenyl]-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[3-(cyclohexanecarbonylamino)benzoyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[3-(cyclohexanecarbonylamino)benzoyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC(=CC=C2)NC(=O)C3CCCCC3

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC(=CC=C2)NC(=O)C3CCCCC3

InChI

InChI=1S/C21H25N3O4S/c1-2-28-18(25)12-17-13-29-21(23-17)24-20(27)15-9-6-10-16(11-15)22-19(26)14-7-4-3-5-8-14/h6,9-11,13-14H,2-5,7-8,12H2,1H3,(H,22,26)(H,23,24,27)