(3S)-3-methyl-4-[(2R)-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-2-oxidanyl-propyl]-N-(4-phenylphenyl)piperazine-1-carboxamide

Systemtic Name: (3S)-3-methyl-4-[(2R)-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-2-oxidanyl-propyl]-N-(4-phenylphenyl)piperazine-1-carboxamide Openeye Name: (3S)-4-[(2R)-2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]-3-methyl-N-(4-phenylphenyl)piperazine-1-carboxamide CAS Name: (3S)-4-[(2R)-2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]-3-methyl-N-(4-phenylphenyl)-1-piperazinecarboxamide IUPAC Name: (3S)-4-[(2R)-2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]-3-methyl-N-(4-phenylphenyl)piperazine-1-carboxamide Traditional Name: (3S)-4-[(2R)-2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]-3-methyl-N-(4-phenylphenyl)piperazine-1-carboxamide Formula: C29H32N4O3S MolecularWeight: 516.65438

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC(COC2=CC3=C(C=C2)SC(=N3)C)O)C(=O)NC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C[C@H]1CN(CCN1C[C@H](COC2=CC3=C(C=C2)SC(=N3)C)O)C(=O)NC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H32N4O3S/c1-20-17-33(29(35)31-24-10-8-23(9-11-24)22-6-4-3-5-7-22)15-14-32(20)18-25(34)19-36-26-12-13-28-27(16-26)30-21(2)37-28/h3-13,16,20,25,34H,14-15,17-19H2,1-2H3,(H,31,35)/t20-,25+/m0/s1