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

Systemtic Name: 1-butyl-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-butyl-urea CAS Name: 1-butyl-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-butylurea Traditional Name: 1-[[1-(3-benzyl-1,2,4-thiadiazol-5-yl)-4-piperidyl]methyl]-3-butyl-urea Formula: C20H29N5OS MolecularWeight: 387.54216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NCC1CCN(CC1)C2=NC(=NS2)CC3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)NCC1CCN(CC1)C2=NC(=NS2)CC3=CC=CC=C3

InChI

InChI=1S/C20H29N5OS/c1-2-3-11-21-19(26)22-15-17-9-12-25(13-10-17)20-23-18(24-27-20)14-16-7-5-4-6-8-16/h4-8,17H,2-3,9-15H2,1H3,(H2,21,22,26)