(3S)-1-(1-propan-2-ylpiperidin-1-ium-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-(1-propan-2-ylpiperidin-1-ium-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-(1-isopropylpiperidin-1-ium-4-yl)-N-(2-thiazol-4-ylethyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-(1-propan-2-yl-4-piperidin-1-iumyl)-N-[2-(4-thiazolyl)ethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-(1-propan-2-ylpiperidin-1-ium-4-yl)-N-[2-(1,3-thiazol-4-yl)ethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-(1-isopropylpiperidin-1-ium-4-yl)-N-(2-thiazol-4-ylethyl)piperidin-1-ium-3-carboxamide Formula: C19H34N4OS+2 MolecularWeight: 366.56446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)[NH+]2CCCC(C2)C(=O)NCCC3=CSC=N3

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)[NH+]2CCC[C@@H](C2)C(=O)NCCC3=CSC=N3

InChI

InChI=1S/C19H32N4OS/c1-15(2)22-10-6-18(7-11-22)23-9-3-4-16(12-23)19(24)20-8-5-17-13-25-14-21-17/h13-16,18H,3-12H2,1-2H3,(H,20,24)/p+2/t16-/m0/s1