N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-(3-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-(3-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-[(3-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-[(3-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-(3-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-(3-methylpiperidino)sulfonyl-benzamide Formula: C26H25N3O3S2 MolecularWeight: 491.625

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H25N3O3S2/c1-18-6-5-15-29(17-18)34(31,32)22-13-11-19(12-14-22)25(30)27-21-8-4-7-20(16-21)26-28-23-9-2-3-10-24(23)33-26/h2-4,7-14,16,18H,5-6,15,17H2,1H3,(H,27,30)