1-(3,4-dimethylphenyl)-3-[5-(2-pyrrolidin-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[5-(2-pyrrolidin-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-(3,4-dimethylphenyl)-3-[5-(2-pyrrolidin-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-(3,4-dimethylphenyl)-3-[5-[2-(1-pyrrolidinyl)ethylthio]-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[5-(2-pyrrolidin-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-(3,4-dimethylphenyl)-3-[5-(2-pyrrolidinoethylthio)-1,3,4-thiadiazol-2-yl]urea Formula: C17H23N5OS2 MolecularWeight: 377.52742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=NN=C(S2)SCCN3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=NN=C(S2)SCCN3CCCC3)C

InChI

InChI=1S/C17H23N5OS2/c1-12-5-6-14(11-13(12)2)18-15(23)19-16-20-21-17(25-16)24-10-9-22-7-3-4-8-22/h5-6,11H,3-4,7-10H2,1-2H3,(H2,18,19,20,23)