N-[(E)-[cyclohexyl(1,2-dihydropyridin-6-yl)methylidene]amino]pyrrolidine-1-carbothioamide

Systemtic Name: N-[(E)-[cyclohexyl(1,2-dihydropyridin-6-yl)methylidene]amino]pyrrolidine-1-carbothioamide Openeye Name: N-[(E)-[cyclohexyl(1,2-dihydropyridin-6-yl)methylene]amino]pyrrolidine-1-carbothioamide CAS Name: N-[(E)-[cyclohexyl(1,2-dihydropyridin-6-yl)methylidene]amino]-1-pyrrolidinecarbothioamide IUPAC Name: N-[(E)-[cyclohexyl(1,2-dihydropyridin-6-yl)methylidene]amino]pyrrolidine-1-carbothioamide Traditional Name: N-[(E)-[cyclohexyl(1,2-dihydropyridin-6-yl)methylene]amino]pyrrolidine-1-carbothioamide Formula: C17H26N4S MolecularWeight: 318.48014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=NNC(=S)N2CCCC2)C3=CC=CCN3

Isomeric SMILES

C1CCC(CC1)/C(=N\NC(=S)N2CCCC2)/C3=CC=CCN3

InChI

InChI=1S/C17H26N4S/c22-17(21-12-6-7-13-21)20-19-16(14-8-2-1-3-9-14)15-10-4-5-11-18-15/h4-5,10,14,18H,1-3,6-9,11-13H2,(H,20,22)/b19-16+