[4-[2-oxidanyl-3-(thiophen-2-ylmethoxy)propyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone

Systemtic Name: [4-[2-oxidanyl-3-(thiophen-2-ylmethoxy)propyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone Openeye Name: [4-[2-hydroxy-3-(2-thienylmethoxy)propyl]piperazin-1-yl]-(4-isopropylphenyl)methanone CAS Name: [4-[2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]-1-piperazinyl]-(4-propan-2-ylphenyl)methanone IUPAC Name: [4-[2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone Traditional Name: [4-[2-hydroxy-3-(2-thenyloxy)propyl]piperazino]-p-cumenyl-methanone Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(COCC3=CC=CS3)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC(COCC3=CC=CS3)O

InChI

InChI=1S/C22H30N2O3S/c1-17(2)18-5-7-19(8-6-18)22(26)24-11-9-23(10-12-24)14-20(25)15-27-16-21-4-3-13-28-21/h3-8,13,17,20,25H,9-12,14-16H2,1-2H3