methyl 2-[[4-(2-diethylaminoethyloxycarbonyl)phenyl]carbamothioylamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[4-(2-diethylaminoethyloxycarbonyl)phenyl]carbamothioylamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[4-(2-diethylaminoethyloxycarbonyl)phenyl]carbamothioylamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[[4-[2-diethylaminoethyloxy(oxo)methyl]anilino]-sulfanylidenemethyl]amino]-5-[diethylamino(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(2-diethylaminoethyloxycarbonyl)phenyl]carbamothioylamino]-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-[[4-(2-diethylaminoethyloxycarbonyl)phenyl]thiocarbamoylamino]-5-(diethylcarbamoyl)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C26H36N4O5S2 MolecularWeight: 548.71784

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=C(C(=C(S2)C(=O)N(CC)CC)C)C(=O)OC

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2=C(C(=C(S2)C(=O)N(CC)CC)C)C(=O)OC

InChI

InChI=1S/C26H36N4O5S2/c1-7-29(8-2)15-16-35-24(32)18-11-13-19(14-12-18)27-26(36)28-22-20(25(33)34-6)17(5)21(37-22)23(31)30(9-3)10-4/h11-14H,7-10,15-16H2,1-6H3,(H2,27,28,36)