methyl 4-[[3-aminocarbonyl-4-methyl-5-(phenylmethyl)thiophen-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[3-aminocarbonyl-4-methyl-5-(phenylmethyl)thiophen-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[(5-benzyl-3-carbamoyl-4-methyl-2-thienyl)amino]-4-oxo-butanoate CAS Name: 4-[[3-carbamoyl-4-methyl-5-(phenylmethyl)-2-thiophenyl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[(5-benzyl-3-carbamoyl-4-methylthiophen-2-yl)amino]-4-oxobutanoate Traditional Name: 4-[(5-benzyl-3-carbamoyl-4-methyl-2-thienyl)amino]-4-keto-butyric acid methyl ester Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)CCC(=O)OC)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)CCC(=O)OC)CC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O4S/c1-11-13(10-12-6-4-3-5-7-12)25-18(16(11)17(19)23)20-14(21)8-9-15(22)24-2/h3-7H,8-10H2,1-2H3,(H2,19,23)(H,20,21)