1-cyclohexyl-3-[[1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperidin-4-yl]methyl]urea

Systemtic Name: 1-cyclohexyl-3-[[1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperidin-4-yl]methyl]urea Openeye Name: 1-[[1-(3-benzyl-1,2,4-thiadiazol-5-yl)-4-piperidyl]methyl]-3-cyclohexyl-urea CAS Name: 1-cyclohexyl-3-[[1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-4-piperidinyl]methyl]urea IUPAC Name: 1-[[1-(3-benzyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]-3-cyclohexylurea Traditional Name: 1-[[1-(3-benzyl-1,2,4-thiadiazol-5-yl)-4-piperidyl]methyl]-3-cyclohexyl-urea Formula: C22H31N5OS MolecularWeight: 413.57944

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NCC2CCN(CC2)C3=NC(=NS3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)NCC2CCN(CC2)C3=NC(=NS3)CC4=CC=CC=C4

InChI

InChI=1S/C22H31N5OS/c28-21(24-19-9-5-2-6-10-19)23-16-18-11-13-27(14-12-18)22-25-20(26-29-22)15-17-7-3-1-4-8-17/h1,3-4,7-8,18-19H,2,5-6,9-16H2,(H2,23,24,28)