1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea

Systemtic Name: 1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea Openeye Name: 1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea CAS Name: 1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]urea IUPAC Name: 1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea Traditional Name: 1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[2-(pyrrolidinomethyl)benzyl]urea Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)NCC2=CC=CC=C2CN3CCCC3

Isomeric SMILES

CC1=NN=C(S1)NC(=O)NCC2=CC=CC=C2CN3CCCC3

InChI

InChI=1S/C16H21N5OS/c1-12-19-20-16(23-12)18-15(22)17-10-13-6-2-3-7-14(13)11-21-8-4-5-9-21/h2-3,6-7H,4-5,8-11H2,1H3,(H2,17,18,20,22)