5-phenyl-4-[(4-propan-2-ylpiperazin-1-yl)carbonylamino]pentanethioic S-acid

Systemtic Name: 5-phenyl-4-[(4-propan-2-ylpiperazin-1-yl)carbonylamino]pentanethioic S-acid Openeye Name: 4-[(4-isopropylpiperazine-1-carbonyl)amino]-5-phenyl-pentanethioic S-acid CAS Name: 4-[[oxo-(4-propan-2-yl-1-piperazinyl)methyl]amino]-5-phenylpentanethioic S-acid IUPAC Name: 5-phenyl-4-[(4-propan-2-ylpiperazine-1-carbonyl)amino]pentanethioic S-acid Traditional Name: 4-[(4-isopropylpiperazine-1-carbonyl)amino]-5-phenyl-thiovaleric acid Formula: C19H29N3O2S MolecularWeight: 363.51746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)NC(CCC(=O)S)CC2=CC=CC=C2

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)NC(CCC(=O)S)CC2=CC=CC=C2

InChI

InChI=1S/C19H29N3O2S/c1-15(2)21-10-12-22(13-11-21)19(24)20-17(8-9-18(23)25)14-16-6-4-3-5-7-16/h3-7,15,17H,8-14H2,1-2H3,(H,20,24)(H,23,25)