N-[(1R,3S,4R)-4-[(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)carbamoylamino]-3-[[methyl(3-phenylpropyl)amino]methyl]cyclohexyl]-N-methyl-ethanamide

Systemtic Name: N-[(1R,3S,4R)-4-[(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)carbamoylamino]-3-[[methyl(3-phenylpropyl)amino]methyl]cyclohexyl]-N-methyl-ethanamide Openeye Name: N-[(1R,3S,4R)-4-[(5-acetyl-4-methyl-thiazol-2-yl)carbamoylamino]-3-[[methyl(3-phenylpropyl)amino]methyl]cyclohexyl]-N-methyl-acetamide CAS Name: N-[(1R,3S,4R)-4-[[[(5-acetyl-4-methyl-2-thiazolyl)amino]-oxomethyl]amino]-3-[[methyl(3-phenylpropyl)amino]methyl]cyclohexyl]-N-methylacetamide IUPAC Name: N-[(1R,3S,4R)-4-[(5-acetyl-4-methyl-1,3-thiazol-2-yl)carbamoylamino]-3-[[methyl(3-phenylpropyl)amino]methyl]cyclohexyl]-N-methylacetamide Traditional Name: N-[(1R,3S,4R)-4-[(5-acetyl-4-methyl-thiazol-2-yl)carbamoylamino]-3-[[methyl(3-phenylpropyl)amino]methyl]cyclohexyl]-N-methyl-acetamide Formula: C27H39N5O3S MolecularWeight: 513.69526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)NC2CCC(CC2CN(C)CCCC3=CC=CC=C3)N(C)C(=O)C)C(=O)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)N[C@@H]2CC[C@H](C[C@H]2CN(C)CCCC3=CC=CC=C3)N(C)C(=O)C)C(=O)C

InChI

InChI=1S/C27H39N5O3S/c1-18-25(19(2)33)36-27(28-18)30-26(35)29-24-14-13-23(32(5)20(3)34)16-22(24)17-31(4)15-9-12-21-10-7-6-8-11-21/h6-8,10-11,22-24H,9,12-17H2,1-5H3,(H2,28,29,30,35)/t22-,23+,24+/m0/s1