(3-methylthiophen-2-yl)-[(3S)-1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone

Systemtic Name: (3-methylthiophen-2-yl)-[(3S)-1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone Openeye Name: [(3S)-1-[(4-isopropylthiazol-2-yl)methyl]piperidin-1-ium-3-yl]-(3-methyl-2-thienyl)methanone CAS Name: (3-methyl-2-thiophenyl)-[(3S)-1-[(4-propan-2-yl-2-thiazolyl)methyl]-3-piperidin-1-iumyl]methanone IUPAC Name: (3-methylthiophen-2-yl)-[(3S)-1-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]piperidin-1-ium-3-yl]methanone Traditional Name: [(3S)-1-[(4-isopropylthiazol-2-yl)methyl]piperidin-1-ium-3-yl]-(3-methyl-2-thienyl)methanone Formula: C18H25N2OS2+ MolecularWeight: 349.5339

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)C2CCC[NH+](C2)CC3=NC(=CS3)C(C)C

Isomeric SMILES

CC1=C(SC=C1)C(=O)[C@H]2CCC[NH+](C2)CC3=NC(=CS3)C(C)C

InChI

InChI=1S/C18H24N2OS2/c1-12(2)15-11-23-16(19-15)10-20-7-4-5-14(9-20)17(21)18-13(3)6-8-22-18/h6,8,11-12,14H,4-5,7,9-10H2,1-3H3/p+1/t14-/m0/s1