2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)ethanone

Systemtic Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)ethanone Openeye Name: 1-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethanone CAS Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)ethanone IUPAC Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)ethanone Traditional Name: 1-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethanone Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)CN(C)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)CN(C)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H23N3OS/c1-5-10-23-14(2)11-16(15(23)3)18(24)12-22(4)13-20-21-17-8-6-7-9-19(17)25-20/h5-9,11H,1,10,12-13H2,2-4H3