2-[4-[(3-chloranyl-6-nitro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-N-(4-phenyl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[4-[(3-chloranyl-6-nitro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-N-(4-phenyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[4-(3-chloro-6-nitro-benzothiophene-2-carbonyl)piperazin-1-yl]-N-(4-phenylthiazol-2-yl)acetamide CAS Name: 2-[4-[(3-chloro-6-nitro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]-N-(4-phenyl-2-thiazolyl)acetamide IUPAC Name: 2-[4-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)piperazin-1-yl]-N-(4-phenyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-[4-(3-chloro-6-nitro-benzothiophene-2-carbonyl)piperazino]-N-(4-phenylthiazol-2-yl)acetamide Formula: C24H20ClN5O4S2 MolecularWeight: 542.0297

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=NC(=CS2)C3=CC=CC=C3)C(=O)C4=C(C5=C(S4)C=C(C=C5)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=NC(=CS2)C3=CC=CC=C3)C(=O)C4=C(C5=C(S4)C=C(C=C5)[N+](=O)[O-])Cl

InChI

InChI=1S/C24H20ClN5O4S2/c25-21-17-7-6-16(30(33)34)12-19(17)36-22(21)23(32)29-10-8-28(9-11-29)13-20(31)27-24-26-18(14-35-24)15-4-2-1-3-5-15/h1-7,12,14H,8-11,13H2,(H,26,27,31)