2-(aminocarbonylamino)-3-methyl-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]butanamide

Systemtic Name: 2-(aminocarbonylamino)-3-methyl-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]butanamide Openeye Name: 3-methyl-N-[1-(p-tolylsulfonyl)-4-piperidyl]-2-ureido-butanamide CAS Name: 2-(carbamoylamino)-3-methyl-N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]butanamide IUPAC Name: 2-(carbamoylamino)-3-methyl-N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]butanamide Traditional Name: 3-methyl-N-(1-tosyl-4-piperidyl)-2-ureido-butyramide Formula: C18H28N4O4S MolecularWeight: 396.50432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C(C(C)C)NC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C(C(C)C)NC(=O)N

InChI

InChI=1S/C18H28N4O4S/c1-12(2)16(21-18(19)24)17(23)20-14-8-10-22(11-9-14)27(25,26)15-6-4-13(3)5-7-15/h4-7,12,14,16H,8-11H2,1-3H3,(H,20,23)(H3,19,21,24)