(E)-3-(1,3-benzothiazol-2-yl)-1-[4-(3-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(1,3-benzothiazol-2-yl)-1-[4-(3-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(1,3-benzothiazol-2-yl)-1-[4-(3-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-1-[4-(3-methoxyphenyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(1,3-benzothiazol-2-yl)-1-[4-(3-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)-1-[4-(3-methoxyphenyl)piperazino]prop-2-en-1-one Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C=CC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)/C=C/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H21N3O2S/c1-26-17-6-4-5-16(15-17)23-11-13-24(14-12-23)21(25)10-9-20-22-18-7-2-3-8-19(18)27-20/h2-10,15H,11-14H2,1H3/b10-9+