5-[[3-aminocarbonyl-4-(3,4-dimethylphenyl)thiophen-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[3-aminocarbonyl-4-(3,4-dimethylphenyl)thiophen-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[[3-carbamoyl-4-(3,4-dimethylphenyl)-2-thienyl]amino]-5-oxo-pentanoic acid CAS Name: 5-[[3-carbamoyl-4-(3,4-dimethylphenyl)-2-thiophenyl]amino]-5-oxopentanoic acid IUPAC Name: 5-[[3-carbamoyl-4-(3,4-dimethylphenyl)thiophen-2-yl]amino]-5-oxopentanoic acid Traditional Name: 5-[[3-carbamoyl-4-(3,4-dimethylphenyl)-2-thienyl]amino]-5-keto-valeric acid Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=C2C(=O)N)NC(=O)CCCC(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=C2C(=O)N)NC(=O)CCCC(=O)O)C

InChI

InChI=1S/C18H20N2O4S/c1-10-6-7-12(8-11(10)2)13-9-25-18(16(13)17(19)24)20-14(21)4-3-5-15(22)23/h6-9H,3-5H2,1-2H3,(H2,19,24)(H,20,21)(H,22,23)