(2E)-2-(1-azanyl-2-methyl-2-pyridin-3-yl-pyrrolidin-3-ylidene)cyclohexane-1-carbothioamide

Systemtic Name: (2E)-2-(1-azanyl-2-methyl-2-pyridin-3-yl-pyrrolidin-3-ylidene)cyclohexane-1-carbothioamide Openeye Name: (2E)-2-[1-amino-2-methyl-2-(3-pyridyl)pyrrolidin-3-ylidene]cyclohexanecarbothioamide CAS Name: (2E)-2-[1-amino-2-methyl-2-(3-pyridinyl)-3-pyrrolidinylidene]-1-cyclohexanecarbothioamide IUPAC Name: (2E)-2-(1-amino-2-methyl-2-pyridin-3-ylpyrrolidin-3-ylidene)cyclohexane-1-carbothioamide Traditional Name: (2E)-2-[1-amino-2-methyl-2-(3-pyridyl)pyrrolidin-3-ylidene]cyclohexanecarbothioamide Formula: C17H24N4S MolecularWeight: 316.46426

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C2CCCCC2C(=S)N)CCN1N)C3=CN=CC=C3

Isomeric SMILES

CC1(/C(=C/2\CCCCC2C(=S)N)/CCN1N)C3=CN=CC=C3

InChI

InChI=1S/C17H24N4S/c1-17(12-5-4-9-20-11-12)15(8-10-21(17)19)13-6-2-3-7-14(13)16(18)22/h4-5,9,11,14H,2-3,6-8,10,19H2,1H3,(H2,18,22)/b15-13+