N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methylphenyl)sulfonylamino]-4-piperidin-1-yl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methylphenyl)sulfonylamino]-4-piperidin-1-yl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(1-piperidyl)-3-(p-tolylsulfonylamino)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methylphenyl)sulfonylamino]-4-(1-piperidinyl)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methylphenyl)sulfonylamino]-4-piperidin-1-ylbenzamide Traditional Name: 4-piperidino-N-piperonyl-3-(tosylamino)benzamide Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)N5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)N5CCCCC5

InChI

InChI=1S/C27H29N3O5S/c1-19-5-9-22(10-6-19)36(32,33)29-23-16-21(8-11-24(23)30-13-3-2-4-14-30)27(31)28-17-20-7-12-25-26(15-20)35-18-34-25/h5-12,15-16,29H,2-4,13-14,17-18H2,1H3,(H,28,31)