N-(3-cyano-4-ethyl-phenyl)-4-methyl-2-[[(7E,10E)-2-methylheptadeca-7,10-dienyl]amino]-4,5-dihydroimidazole-1-carbothioamide

Systemtic Name: N-(3-cyano-4-ethyl-phenyl)-4-methyl-2-[[(7E,10E)-2-methylheptadeca-7,10-dienyl]amino]-4,5-dihydroimidazole-1-carbothioamide Openeye Name: N-(3-cyano-4-ethyl-phenyl)-4-methyl-2-[[(7E,10E)-2-methylheptadeca-7,10-dienyl]amino]-4,5-dihydroimidazole-1-carbothioamide CAS Name: N-(3-cyano-4-ethylphenyl)-4-methyl-2-[[(7E,10E)-2-methylheptadeca-7,10-dienyl]amino]-4,5-dihydroimidazole-1-carbothioamide IUPAC Name: N-(3-cyano-4-ethylphenyl)-4-methyl-2-[[(7E,10E)-2-methylheptadeca-7,10-dienyl]amino]-4,5-dihydroimidazole-1-carbothioamide Traditional Name: N-(3-cyano-4-ethyl-phenyl)-4-methyl-2-[[(7E,10E)-2-methylheptadeca-7,10-dienyl]amino]-2-imidazoline-1-carbothioamide Formula: C32H49N5S MolecularWeight: 535.82996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CCC=CCCCCC(C)CNC1=NC(CN1C(=S)NC2=CC(=C(C=C2)CC)C#N)C

Isomeric SMILES

CCCCCC/C=C/C/C=C/CCCCC(C)CNC1=NC(CN1C(=S)NC2=CC(=C(C=C2)CC)C#N)C

InChI

InChI=1S/C32H49N5S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-26(3)24-34-31-35-27(4)25-37(31)32(38)36-30-21-20-28(6-2)29(22-30)23-33/h11-12,14-15,20-22,26-27H,5-10,13,16-19,24-25H2,1-4H3,(H,34,35)(H,36,38)/b12-11+,15-14+