1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-3-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]urea

Systemtic Name: 1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-3-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]urea Openeye Name: 1-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-[(6-pyrrolidin-1-yl-3-pyridyl)methyl]urea CAS Name: 1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-3-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]urea IUPAC Name: 1-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-3-[(6-pyrrolidin-1-ylpyridin-3-yl)methyl]urea Traditional Name: 1-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-[(6-pyrrolidino-3-pyridyl)methyl]urea Formula: C16H22N6OS MolecularWeight: 346.45048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)NC(=O)NCC2=CN=C(C=C2)N3CCCC3

Isomeric SMILES

CC(C)C1=NN=C(S1)NC(=O)NCC2=CN=C(C=C2)N3CCCC3

InChI

InChI=1S/C16H22N6OS/c1-11(2)14-20-21-16(24-14)19-15(23)18-10-12-5-6-13(17-9-12)22-7-3-4-8-22/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H2,18,19,21,23)