N-(2-morpholin-4-ylethyl)-4-(4-nitrophenyl)-2-phenyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-(2-morpholin-4-ylethyl)-4-(4-nitrophenyl)-2-phenyl-1,3-thiazole-5-carboxamide Openeye Name: N-(2-morpholinoethyl)-4-(4-nitrophenyl)-2-phenyl-thiazole-5-carboxamide CAS Name: N-[2-(4-morpholinyl)ethyl]-4-(4-nitrophenyl)-2-phenyl-5-thiazolecarboxamide IUPAC Name: N-(2-morpholin-4-ylethyl)-4-(4-nitrophenyl)-2-phenyl-1,3-thiazole-5-carboxamide Traditional Name: N-(2-morpholinoethyl)-4-(4-nitrophenyl)-2-phenyl-thiazole-5-carboxamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(=O)C2=C(N=C(S2)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCNC(=O)C2=C(N=C(S2)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O4S/c27-21(23-10-11-25-12-14-30-15-13-25)20-19(16-6-8-18(9-7-16)26(28)29)24-22(31-20)17-4-2-1-3-5-17/h1-9H,10-15H2,(H,23,27)