1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-(4-methylphenoxy)butan-1-one

Systemtic Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-(4-methylphenoxy)butan-1-one Openeye Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidyl]-4-(4-methylphenoxy)butan-1-one CAS Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)-1-piperidinyl]-4-(4-methylphenoxy)-1-butanone IUPAC Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-(4-methylphenoxy)butan-1-one Traditional Name: 1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidino]-4-(4-methylphenoxy)butan-1-one Formula: C23H26N2O2S MolecularWeight: 394.52974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCCC(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)OCCCC(=O)N2CCC[C@H](C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H26N2O2S/c1-17-10-12-19(13-11-17)27-15-5-9-22(26)25-14-4-6-18(16-25)23-24-20-7-2-3-8-21(20)28-23/h2-3,7-8,10-13,18H,4-6,9,14-16H2,1H3/t18-/m1/s1