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

Systemtic Name: N-(2-dimethylaminoethyl)-4-(3-nitrophenyl)-2-phenyl-1,3-thiazole-5-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-4-(3-nitrophenyl)-2-phenyl-thiazole-5-carboxamide CAS Name: N-(2-dimethylaminoethyl)-4-(3-nitrophenyl)-2-phenyl-5-thiazolecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(3-nitrophenyl)-2-phenyl-1,3-thiazole-5-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-4-(3-nitrophenyl)-2-phenyl-thiazole-5-carboxamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=C(N=C(S1)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCNC(=O)C1=C(N=C(S1)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3S/c1-23(2)12-11-21-19(25)18-17(15-9-6-10-16(13-15)24(26)27)22-20(28-18)14-7-4-3-5-8-14/h3-10,13H,11-12H2,1-2H3,(H,21,25)