3,3-dimethyl-1-(5-phenyl-2-propan-2-yl-3H-1,3,4-thiadiazol-2-yl)butan-2-one

Systemtic Name: 3,3-dimethyl-1-(5-phenyl-2-propan-2-yl-3H-1,3,4-thiadiazol-2-yl)butan-2-one Openeye Name: 1-(2-isopropyl-5-phenyl-3H-1,3,4-thiadiazol-2-yl)-3,3-dimethyl-butan-2-one CAS Name: 3,3-dimethyl-1-(5-phenyl-2-propan-2-yl-3H-1,3,4-thiadiazol-2-yl)-2-butanone IUPAC Name: 3,3-dimethyl-1-(5-phenyl-2-propan-2-yl-3H-1,3,4-thiadiazol-2-yl)butan-2-one Traditional Name: 1-(2-isopropyl-5-phenyl-3H-1,3,4-thiadiazol-2-yl)-3,3-dimethyl-butan-2-one Formula: C17H24N2OS MolecularWeight: 304.45026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(NN=C(S1)C2=CC=CC=C2)CC(=O)C(C)(C)C

Isomeric SMILES

CC(C)C1(NN=C(S1)C2=CC=CC=C2)CC(=O)C(C)(C)C

InChI

InChI=1S/C17H24N2OS/c1-12(2)17(11-14(20)16(3,4)5)19-18-15(21-17)13-9-7-6-8-10-13/h6-10,12,19H,11H2,1-5H3