N-[3-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[(4-tert-butylthiazol-2-yl)amino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[(4-tert-butyl-2-thiazolyl)amino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[(4-tert-butyl-1,3-thiazol-2-yl)amino]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-[(4-tert-butylthiazol-2-yl)amino]-3-keto-propyl]-4-nitro-benzamide Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4S/c1-17(2,3)13-10-26-16(19-13)20-14(22)8-9-18-15(23)11-4-6-12(7-5-11)21(24)25/h4-7,10H,8-9H2,1-3H3,(H,18,23)(H,19,20,22)