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

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-[3-(2-methylpiperidin-1-yl)propylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-[3-(2-methyl-1-piperidyl)propylcarbamoylamino]-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[[[3-(2-methyl-1-piperidinyl)propylamino]-oxomethyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-[3-(2-methylpiperidin-1-yl)propylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-[3-(2-methylpiperidino)propylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Formula: C25H30ClN5O2S MolecularWeight: 500.056

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=C(C=CC=C4Cl)C

Isomeric SMILES

CC1CCCCN1CCCNC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=C(C=CC=C4Cl)C

InChI

InChI=1S/C25H30ClN5O2S/c1-16-7-5-9-19(26)22(16)29-23(32)18-10-11-20-21(15-18)34-25(28-20)30-24(33)27-12-6-14-31-13-4-3-8-17(31)2/h5,7,9-11,15,17H,3-4,6,8,12-14H2,1-2H3,(H,29,32)(H2,27,28,30,33)