(E)-3-(1,3-benzothiazol-2-yl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(1-isopropylpiperidin-1-ium-4-yl)prop-2-enamide CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(1-propan-2-yl-4-piperidin-1-iumyl)-2-propenamide IUPAC Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)-N-(1-isopropylpiperidin-1-ium-4-yl)acrylamide Formula: C18H24N3OS+ MolecularWeight: 330.46766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC(=O)C=CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NC(=O)/C=C/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H23N3OS/c1-13(2)21-11-9-14(10-12-21)19-17(22)7-8-18-20-15-5-3-4-6-16(15)23-18/h3-8,13-14H,9-12H2,1-2H3,(H,19,22)/p+1/b8-7+