1,5-bis[4-[(5-chloranyl-1,3-benzothiazol-2-yl)-methyl-amino]piperidin-1-yl]pentane-1,5-dione

Systemtic Name: 1,5-bis[4-[(5-chloranyl-1,3-benzothiazol-2-yl)-methyl-amino]piperidin-1-yl]pentane-1,5-dione Openeye Name: 1,5-bis[4-[(5-chloro-1,3-benzothiazol-2-yl)-methyl-amino]-1-piperidyl]pentane-1,5-dione CAS Name: 1,5-bis[4-[(5-chloro-1,3-benzothiazol-2-yl)-methylamino]-1-piperidinyl]pentane-1,5-dione IUPAC Name: 1,5-bis[4-[(5-chloro-1,3-benzothiazol-2-yl)-methylamino]piperidin-1-yl]pentane-1,5-dione Traditional Name: 1,5-bis[4-[(5-chloro-1,3-benzothiazol-2-yl)-methyl-amino]piperidino]pentane-1,5-dione Formula: C31H36Cl2N6O2S2 MolecularWeight: 659.69254

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(CC1)C(=O)CCCC(=O)N2CCC(CC2)N(C)C3=NC4=C(S3)C=CC(=C4)Cl)C5=NC6=C(S5)C=CC(=C6)Cl

Isomeric SMILES

CN(C1CCN(CC1)C(=O)CCCC(=O)N2CCC(CC2)N(C)C3=NC4=C(S3)C=CC(=C4)Cl)C5=NC6=C(S5)C=CC(=C6)Cl

InChI

InChI=1S/C31H36Cl2N6O2S2/c1-36(30-34-24-18-20(32)6-8-26(24)42-30)22-10-14-38(15-11-22)28(40)4-3-5-29(41)39-16-12-23(13-17-39)37(2)31-35-25-19-21(33)7-9-27(25)43-31/h6-9,18-19,22-23H,3-5,10-17H2,1-2H3