N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[4-(4-chlorophenyl)thiazol-2-yl]-2-morpholino-5-nitro-benzamide CAS Name: N-[4-(4-chlorophenyl)-2-thiazolyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[4-(4-chlorophenyl)thiazol-2-yl]-2-morpholino-5-nitro-benzamide Formula: C20H17ClN4O4S MolecularWeight: 444.89138

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC(=CS3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H17ClN4O4S/c21-14-3-1-13(2-4-14)17-12-30-20(22-17)23-19(26)16-11-15(25(27)28)5-6-18(16)24-7-9-29-10-8-24/h1-6,11-12H,7-10H2,(H,22,23,26)