N-[3-[(6-bromanylnaphthalen-2-yl)sulfonylamino]-1-oxidanylidene-1-thiomorpholin-4-yl-propan-2-yl]-4-pyridin-4-yl-piperazine-1-carboxamide

Systemtic Name: N-[3-[(6-bromanylnaphthalen-2-yl)sulfonylamino]-1-oxidanylidene-1-thiomorpholin-4-yl-propan-2-yl]-4-pyridin-4-yl-piperazine-1-carboxamide Openeye Name: N-[1-[[(6-bromo-2-naphthyl)sulfonylamino]methyl]-2-oxo-2-thiomorpholino-ethyl]-4-(4-pyridyl)piperazine-1-carboxamide CAS Name: N-[3-[(6-bromo-2-naphthalenyl)sulfonylamino]-1-oxo-1-thiomorpholin-4-ylpropan-2-yl]-4-pyridin-4-yl-1-piperazinecarboxamide IUPAC Name: N-[3-[(6-bromonaphthalen-2-yl)sulfonylamino]-1-oxo-1-thiomorpholin-4-ylpropan-2-yl]-4-pyridin-4-ylpiperazine-1-carboxamide Traditional Name: N-[1-[[(6-bromo-2-naphthyl)sulfonylamino]methyl]-2-keto-2-thiomorpholino-ethyl]-4-(4-pyridyl)piperazine-1-carboxamide Formula: C27H31BrN6O4S2 MolecularWeight: 647.60684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C(=O)NC(CNS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Br)C(=O)N5CCSCC5

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C(=O)NC(CNS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Br)C(=O)N5CCSCC5

InChI

InChI=1S/C27H31BrN6O4S2/c28-22-3-1-21-18-24(4-2-20(21)17-22)40(37,38)30-19-25(26(35)33-13-15-39-16-14-33)31-27(36)34-11-9-32(10-12-34)23-5-7-29-8-6-23/h1-8,17-18,25,30H,9-16,19H2,(H,31,36)