1-[2-(dimethylaminomethyl)-3-oxidanyl-3-phenyl-propyl]-3-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)urea

Systemtic Name: 1-[2-(dimethylaminomethyl)-3-oxidanyl-3-phenyl-propyl]-3-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)urea Openeye Name: 1-[2-(dimethylaminomethyl)-3-hydroxy-3-phenyl-propyl]-3-(5-isopropyl-1,3,4-thiadiazol-2-yl)urea CAS Name: 1-[2-(dimethylaminomethyl)-3-hydroxy-3-phenylpropyl]-3-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)urea IUPAC Name: 1-[2-(dimethylaminomethyl)-3-hydroxy-3-phenylpropyl]-3-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)urea Traditional Name: 1-[2-(dimethylaminomethyl)-3-hydroxy-3-phenyl-propyl]-3-(5-isopropyl-1,3,4-thiadiazol-2-yl)urea Formula: C18H27N5O2S MolecularWeight: 377.50428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)NC(=O)NCC(CN(C)C)C(C2=CC=CC=C2)O

Isomeric SMILES

CC(C)C1=NN=C(S1)NC(=O)NCC(CN(C)C)C(C2=CC=CC=C2)O

InChI

InChI=1S/C18H27N5O2S/c1-12(2)16-21-22-18(26-16)20-17(25)19-10-14(11-23(3)4)15(24)13-8-6-5-7-9-13/h5-9,12,14-15,24H,10-11H2,1-4H3,(H2,19,20,22,25)