N-[(2R,3R)-3-methyl-1-oxidanylidene-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]pentan-2-yl]heptanamide

Systemtic Name: N-[(2R,3R)-3-methyl-1-oxidanylidene-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]pentan-2-yl]heptanamide Openeye Name: N-[(1R,2R)-2-methyl-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoyl]butyl]heptanamide CAS Name: N-[(2R,3R)-3-methyl-1-oxo-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]pentan-2-yl]heptanamide IUPAC Name: N-[(2R,3R)-3-methyl-1-oxo-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]pentan-2-yl]heptanamide Traditional Name: N-[(1R,2R)-2-methyl-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoyl]butyl]enanthamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NC(C(C)CC)C(=O)NC1=NN=C(S1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC(=O)N[C@H]([C@H](C)CC)C(=O)NC1=NN=C(S1)C2=CC=CC=C2

InChI

InChI=1S/C21H30N4O2S/c1-4-6-7-11-14-17(26)22-18(15(3)5-2)19(27)23-21-25-24-20(28-21)16-12-9-8-10-13-16/h8-10,12-13,15,18H,4-7,11,14H2,1-3H3,(H,22,26)(H,23,25,27)/t15-,18-/m1/s1