N-(2-dimethylaminoethyl)-4-(2-methylpiperidin-1-yl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-(2-methylpiperidin-1-yl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-dimethylaminoethyl)-4-[(2-methyl-1-piperidyl)sulfonyl]-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-dimethylaminoethyl)-4-[(2-methyl-1-piperidinyl)sulfonyl]-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(2-methylpiperidin-1-yl)sulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-dimethylaminoethyl)-4-(2-methylpiperidino)sulfonyl-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C25H32N4O3S3 MolecularWeight: 532.74158

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN(C)C)C3=NC4=C(S3)C=C(C=C4)SC

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN(C)C)C3=NC4=C(S3)C=C(C=C4)SC

InChI

InChI=1S/C25H32N4O3S3/c1-18-7-5-6-14-29(18)35(31,32)21-11-8-19(9-12-21)24(30)28(16-15-27(2)3)25-26-22-13-10-20(33-4)17-23(22)34-25/h8-13,17-18H,5-7,14-16H2,1-4H3