(2S)-N-cyclohexyl-2-[[(S)-(4-methylpyrimidin-2-yl)-phenyl-methyl]amino]-3-phenyl-propanamide

Systemtic Name: (2S)-N-cyclohexyl-2-[[(S)-(4-methylpyrimidin-2-yl)-phenyl-methyl]amino]-3-phenyl-propanamide Openeye Name: (2S)-N-cyclohexyl-2-[[(S)-(4-methylpyrimidin-2-yl)-phenyl-methyl]amino]-3-phenyl-propanamide CAS Name: (2S)-N-cyclohexyl-2-[[(S)-(4-methyl-2-pyrimidinyl)-phenylmethyl]amino]-3-phenylpropanamide IUPAC Name: (2S)-N-cyclohexyl-2-[[(S)-(4-methylpyrimidin-2-yl)-phenylmethyl]amino]-3-phenylpropanamide Traditional Name: (2S)-N-cyclohexyl-2-[[(S)-(4-methylpyrimidin-2-yl)-phenyl-methyl]amino]-3-phenyl-propionamide Formula: C27H32N4O MolecularWeight: 428.56918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)C(C2=CC=CC=C2)NC(CC3=CC=CC=C3)C(=O)NC4CCCCC4

Isomeric SMILES

CC1=NC(=NC=C1)[C@H](C2=CC=CC=C2)N[C@@H](CC3=CC=CC=C3)C(=O)NC4CCCCC4

InChI

InChI=1S/C27H32N4O/c1-20-17-18-28-26(29-20)25(22-13-7-3-8-14-22)31-24(19-21-11-5-2-6-12-21)27(32)30-23-15-9-4-10-16-23/h2-3,5-8,11-14,17-18,23-25,31H,4,9-10,15-16,19H2,1H3,(H,30,32)/t24-,25-/m0/s1