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

Systemtic Name: N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[5-[(4-chlorophenyl)methyl]thiazol-2-yl]-2-morpholino-5-nitro-benzamide CAS Name: N-[5-[(4-chlorophenyl)methyl]-2-thiazolyl]-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[5-(4-chlorobenzyl)thiazol-2-yl]-2-morpholino-5-nitro-benzamide Formula: C21H19ClN4O4S MolecularWeight: 458.91796

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC=C(S3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC=C(S3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H19ClN4O4S/c22-15-3-1-14(2-4-15)11-17-13-23-21(31-17)24-20(27)18-12-16(26(28)29)5-6-19(18)25-7-9-30-10-8-25/h1-6,12-13H,7-11H2,(H,23,24,27)