N-[3-acetamido-4-[2-[[(2S)-6-methylheptan-2-yl]amino]-1,3-thiazol-4-yl]phenyl]ethanamide

Systemtic Name: N-[3-acetamido-4-[2-[[(2S)-6-methylheptan-2-yl]amino]-1,3-thiazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-acetamido-4-[2-[[(1S)-1,5-dimethylhexyl]amino]thiazol-4-yl]phenyl]acetamide CAS Name: N-[3-acetamido-4-[2-[[(2S)-6-methylheptan-2-yl]amino]-4-thiazolyl]phenyl]acetamide IUPAC Name: N-[3-acetamido-4-[2-[[(2S)-6-methylheptan-2-yl]amino]-1,3-thiazol-4-yl]phenyl]acetamide Traditional Name: N-[3-acetamido-4-[2-[[(1S)-1,5-dimethylhexyl]amino]thiazol-4-yl]phenyl]acetamide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC1=NC(=CS1)C2=C(C=C(C=C2)NC(=O)C)NC(=O)C

Isomeric SMILES

C[C@@H](CCCC(C)C)NC1=NC(=CS1)C2=C(C=C(C=C2)NC(=O)C)NC(=O)C

InChI

InChI=1S/C21H30N4O2S/c1-13(2)7-6-8-14(3)22-21-25-20(12-28-21)18-10-9-17(23-15(4)26)11-19(18)24-16(5)27/h9-14H,6-8H2,1-5H3,(H,22,25)(H,23,26)(H,24,27)/t14-/m0/s1