4-(4-nitrophenyl)butyl N-[(2-phenyl-1,3-thiazol-4-yl)carbonylamino]carbamate

Systemtic Name: 4-(4-nitrophenyl)butyl N-[(2-phenyl-1,3-thiazol-4-yl)carbonylamino]carbamate Openeye Name: 4-(4-nitrophenyl)butyl N-[(2-phenylthiazole-4-carbonyl)amino]carbamate CAS Name: N-[[oxo-(2-phenyl-4-thiazolyl)methyl]amino]carbamic acid 4-(4-nitrophenyl)butyl ester IUPAC Name: 4-(4-nitrophenyl)butyl N-[(2-phenyl-1,3-thiazole-4-carbonyl)amino]carbamate Traditional Name: N-[(2-phenylthiazole-4-carbonyl)amino]carbamic acid 4-(4-nitrophenyl)butyl ester Formula: C21H20N4O5S MolecularWeight: 440.4723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CS2)C(=O)NNC(=O)OCCCCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CS2)C(=O)NNC(=O)OCCCCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O5S/c26-19(18-14-31-20(22-18)16-7-2-1-3-8-16)23-24-21(27)30-13-5-4-6-15-9-11-17(12-10-15)25(28)29/h1-3,7-12,14H,4-6,13H2,(H,23,26)(H,24,27)