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

Systemtic Name: ethyl 2-[2-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[3-nitro-4-(1-piperidyl)benzoyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(3-nitro-4-piperidin-1-ylbenzoyl)amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(3-nitro-4-piperidino-benzoyl)amino]thiazol-4-yl]acetic acid ethyl ester Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5S/c1-2-28-17(24)11-14-12-29-19(20-14)21-18(25)13-6-7-15(16(10-13)23(26)27)22-8-4-3-5-9-22/h6-7,10,12H,2-5,8-9,11H2,1H3,(H,20,21,25)