(8-chloranyl-2-methyl-3-prop-2-enyl-quinolin-4-yl) carbamimidothioate

Systemtic Name: (8-chloranyl-2-methyl-3-prop-2-enyl-quinolin-4-yl) carbamimidothioate Openeye Name: 2-(3-allyl-8-chloro-2-methyl-4-quinolyl)isothiourea CAS Name: carbamimidothioic acid (8-chloro-2-methyl-3-prop-2-enyl-4-quinolinyl) ester IUPAC Name: (8-chloro-2-methyl-3-prop-2-enylquinolin-4-yl) carbamimidothioate Traditional Name: 2-(3-allyl-8-chloro-2-methyl-4-quinolyl)isothiourea Formula: C14H14ClN3S MolecularWeight: 291.79906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2Cl)C(=C1CC=C)SC(=N)N

Isomeric SMILES

CC1=NC2=C(C=CC=C2Cl)C(=C1CC=C)SC(=N)N

InChI

InChI=1S/C14H14ClN3S/c1-3-5-9-8(2)18-12-10(6-4-7-11(12)15)13(9)19-14(16)17/h3-4,6-7H,1,5H2,2H3,(H3,16,17)