ethyl 2-(2-methylprop-2-enylcarbamothioylamino)-5,6,7,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: ethyl 2-(2-methylprop-2-enylcarbamothioylamino)-5,6,7,8-tetrahydroquinoline-3-carboxylate Openeye Name: ethyl 2-(2-methylallylcarbamothioylamino)-5,6,7,8-tetrahydroquinoline-3-carboxylate CAS Name: 2-[[(2-methylprop-2-enylamino)-sulfanylidenemethyl]amino]-5,6,7,8-tetrahydroquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-methylprop-2-enylcarbamothioylamino)-5,6,7,8-tetrahydroquinoline-3-carboxylate Traditional Name: 2-(2-methylallylthiocarbamoylamino)-5,6,7,8-tetrahydroquinoline-3-carboxylic acid ethyl ester Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(CCCC2)N=C1NC(=S)NCC(=C)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(CCCC2)N=C1NC(=S)NCC(=C)C

InChI

InChI=1S/C17H23N3O2S/c1-4-22-16(21)13-9-12-7-5-6-8-14(12)19-15(13)20-17(23)18-10-11(2)3/h9H,2,4-8,10H2,1,3H3,(H2,18,19,20,23)