N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-4-(2-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-4-(2-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-4-[(2-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[4-[(1-methyl-2-imidazolyl)thio]phenyl]-4-[(2-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[4-(1-methylimidazol-2-yl)sulfanylphenyl]-4-(2-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[4-[(1-methylimidazol-2-yl)thio]phenyl]-4-(2-methylpiperidino)sulfonyl-benzamide Formula: C23H26N4O3S2 MolecularWeight: 470.60754

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)SC4=NC=CN4C

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)SC4=NC=CN4C

InChI

InChI=1S/C23H26N4O3S2/c1-17-5-3-4-15-27(17)32(29,30)21-12-6-18(7-13-21)22(28)25-19-8-10-20(11-9-19)31-23-24-14-16-26(23)2/h6-14,16-17H,3-5,15H2,1-2H3,(H,25,28)