3-(2-ethylbutanoylamino)-N-[5-[(3R)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3-(2-ethylbutanoylamino)-N-[5-[(3R)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-(2-ethylbutanoylamino)-N-[5-[(3R)-5-oxo-1-phenyl-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-[(2-ethyl-1-oxobutyl)amino]-N-[5-[(3R)-5-oxo-1-phenyl-3-pyrrolidinyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-(2-ethylbutanoylamino)-N-[5-[(3R)-5-oxo-1-phenylpyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3-(2-ethylbutanoylamino)-N-[5-[(3R)-5-keto-1-phenyl-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]benzamide Formula: C25H27N5O3S MolecularWeight: 477.57858

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)C3CC(=O)N(C3)C4=CC=CC=C4

Isomeric SMILES

CCC(CC)C(=O)NC1=CC=CC(=C1)C(=O)NC2=NN=C(S2)[C@@H]3CC(=O)N(C3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N5O3S/c1-3-16(4-2)22(32)26-19-10-8-9-17(13-19)23(33)27-25-29-28-24(34-25)18-14-21(31)30(15-18)20-11-6-5-7-12-20/h5-13,16,18H,3-4,14-15H2,1-2H3,(H,26,32)(H,27,29,33)/t18-/m1/s1