N-(2-chloranyl-6-methyl-phenyl)-2-[3-(diethylamino)propylcarbamoylamino]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-[3-(diethylamino)propylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-[3-(diethylamino)propylcarbamoylamino]-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[[[3-(diethylamino)propylamino]-oxomethyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-[3-(diethylamino)propylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-[3-(diethylamino)propylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Formula: C23H28ClN5O2S MolecularWeight: 474.01872

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)NC3=C(C=CC=C3Cl)C

Isomeric SMILES

CCN(CC)CCCNC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)NC3=C(C=CC=C3Cl)C

InChI

InChI=1S/C23H28ClN5O2S/c1-4-29(5-2)13-7-12-25-22(31)28-23-26-18-11-10-16(14-19(18)32-23)21(30)27-20-15(3)8-6-9-17(20)24/h6,8-11,14H,4-5,7,12-13H2,1-3H3,(H,27,30)(H2,25,26,28,31)