methyl 4-(2-methylpropyl)-2-(prop-2-enylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-(2-methylpropyl)-2-(prop-2-enylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 2-(allylcarbamothioylamino)-4-isobutyl-thiophene-3-carboxylate CAS Name: 4-(2-methylpropyl)-2-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-methylpropyl)-2-(prop-2-enylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 2-(allylthiocarbamoylamino)-4-isobutyl-thiophene-3-carboxylic acid methyl ester Formula: C14H20N2O2S2 MolecularWeight: 312.4508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CSC(=C1C(=O)OC)NC(=S)NCC=C

Isomeric SMILES

CC(C)CC1=CSC(=C1C(=O)OC)NC(=S)NCC=C

InChI

InChI=1S/C14H20N2O2S2/c1-5-6-15-14(19)16-12-11(13(17)18-4)10(8-20-12)7-9(2)3/h5,8-9H,1,6-7H2,2-4H3,(H2,15,16,19)