2H-benzotriazol-5-yl-[4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]methanone

Systemtic Name: 2H-benzotriazol-5-yl-[4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]methanone Openeye Name: 2H-benzotriazol-5-yl-[4-[4-(2-nitrophenyl)thiazol-2-yl]-1-piperidyl]methanone CAS Name: 2H-benzotriazol-5-yl-[4-[4-(2-nitrophenyl)-2-thiazolyl]-1-piperidinyl]methanone IUPAC Name: 2H-benzotriazol-5-yl-[4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]methanone Traditional Name: 2H-benzotriazol-5-yl-[4-[4-(2-nitrophenyl)thiazol-2-yl]piperidino]methanone Formula: C21H18N6O3S MolecularWeight: 434.47102

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C3=CC=CC=C3[N+](=O)[O-])C(=O)C4=CC5=NNN=C5C=C4

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C3=CC=CC=C3[N+](=O)[O-])C(=O)C4=CC5=NNN=C5C=C4

InChI

InChI=1S/C21H18N6O3S/c28-21(14-5-6-16-17(11-14)24-25-23-16)26-9-7-13(8-10-26)20-22-18(12-31-20)15-3-1-2-4-19(15)27(29)30/h1-6,11-13H,7-10H2,(H,23,24,25)