4-chloranyl-N-[5-[[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]-5-(pyridin-4-ylmethylamino)-1,2-thiazole-3-carboxamide

Systemtic Name: 4-chloranyl-N-[5-[[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]-5-(pyridin-4-ylmethylamino)-1,2-thiazole-3-carboxamide Openeye Name: 4-chloro-N-[5-[[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]-5-(4-pyridylmethylamino)isothiazole-3-carboxamide CAS Name: 4-chloro-N-[5-[[[5-[[[5-[[3-(dimethylamino)propylamino]-oxomethyl]-1-methyl-3-pyrrolyl]amino]-oxomethyl]-1-methyl-3-pyrrolyl]amino]-oxomethyl]-1-methyl-3-pyrrolyl]-5-(pyridin-4-ylmethylamino)-3-isothiazolecarboxamide IUPAC Name: 4-chloro-N-[5-[[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-5-(pyridin-4-ylmethylamino)-1,2-thiazole-3-carboxamide Traditional Name: 4-chloro-N-[5-[[5-[[5-[3-(dimethylamino)propylcarbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]-5-(4-pyridylmethylamino)isothiazole-3-carboxamide Formula: C33H38ClN11O4S MolecularWeight: 720.24412

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCCN(C)C)NC(=O)C2=CC(=CN2C)NC(=O)C3=CC(=CN3C)NC(=O)C4=NSC(=C4Cl)NCC5=CC=NC=C5

Isomeric SMILES

CN1C=C(C=C1C(=O)NCCCN(C)C)NC(=O)C2=CC(=CN2C)NC(=O)C3=CC(=CN3C)NC(=O)C4=NSC(=C4Cl)NCC5=CC=NC=C5

InChI

InChI=1S/C33H38ClN11O4S/c1-42(2)12-6-9-36-29(46)24-13-21(17-43(24)3)38-30(47)25-14-22(18-44(25)4)39-31(48)26-15-23(19-45(26)5)40-32(49)28-27(34)33(50-41-28)37-16-20-7-10-35-11-8-20/h7-8,10-11,13-15,17-19,37H,6,9,12,16H2,1-5H3,(H,36,46)(H,38,47)(H,39,48)(H,40,49)