(E)-1-[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(3-methoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(3-methoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-[2-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-(3-methoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-[2-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-(3-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(3-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-[2-(1,3-benzothiazol-2-yl)piperidino]-3-(3-methoxyphenyl)prop-2-en-1-one Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=CC(=O)N2CCCCC2C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=CC(=C1)/C=C/C(=O)N2CCCCC2C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H22N2O2S/c1-26-17-8-6-7-16(15-17)12-13-21(25)24-14-5-4-10-19(24)22-23-18-9-2-3-11-20(18)27-22/h2-3,6-9,11-13,15,19H,4-5,10,14H2,1H3/b13-12+