2-[4-[(3-chloranyl-6-nitro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-[4-[(3-chloranyl-6-nitro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-[4-(3-chloro-6-nitro-benzothiophene-2-carbonyl)piperazin-1-yl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-[4-[(3-chloro-6-nitro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-[4-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)piperazin-1-yl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-[4-(3-chloro-6-nitro-benzothiophene-2-carbonyl)piperazino]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C23H25ClN6O4S2 MolecularWeight: 549.0654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(S2)NC(=O)CN3CCN(CC3)C(=O)C4=C(C5=C(S4)C=C(C=C5)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCC(CC1)C2=NN=C(S2)NC(=O)CN3CCN(CC3)C(=O)C4=C(C5=C(S4)C=C(C=C5)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H25ClN6O4S2/c24-19-16-7-6-15(30(33)34)12-17(16)35-20(19)22(32)29-10-8-28(9-11-29)13-18(31)25-23-27-26-21(36-23)14-4-2-1-3-5-14/h6-7,12,14H,1-5,8-11,13H2,(H,25,27,31)