N-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-[4-(3,4-dichlorophenyl)thiazol-2-yl]-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-[4-(3,4-dichlorophenyl)-2-thiazolyl]-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-[4-(3,4-dichlorophenyl)thiazol-2-yl]-5-nitro-2-piperidino-benzamide Formula: C21H18Cl2N4O3S MolecularWeight: 477.36362

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC(=CS3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC(=CS3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H18Cl2N4O3S/c22-16-6-4-13(10-17(16)23)18-12-31-21(24-18)25-20(28)15-11-14(27(29)30)5-7-19(15)26-8-2-1-3-9-26/h4-7,10-12H,1-3,8-9H2,(H,24,25,28)