4-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)butanethioamide

Systemtic Name: 4-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)butanethioamide Openeye Name: 4-(2-isopropyl-1H-imidazol-3-ium-3-yl)butanethioamide CAS Name: 4-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)butanethioamide IUPAC Name: 4-(2-propan-2-yl-1H-imidazol-3-ium-3-yl)butanethioamide Traditional Name: 4-(2-isopropyl-1H-imidazol-3-ium-3-yl)thiobutyramide Formula: C10H18N3S+ MolecularWeight: 212.33502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](C=CN1)CCCC(=S)N

Isomeric SMILES

CC(C)C1=[N+](C=CN1)CCCC(=S)N

InChI

InChI=1S/C10H17N3S/c1-8(2)10-12-5-7-13(10)6-3-4-9(11)14/h5,7-8H,3-4,6H2,1-2H3,(H2,11,14)/p+1