5-(2-methylpropylcarbamoylamino)-3-[(5-methylthiophen-2-yl)methylsulfanyl]-1,2-thiazole-4-carboxylic acid

Systemtic Name: 5-(2-methylpropylcarbamoylamino)-3-[(5-methylthiophen-2-yl)methylsulfanyl]-1,2-thiazole-4-carboxylic acid Openeye Name: 5-(isobutylcarbamoylamino)-3-[(5-methyl-2-thienyl)methylsulfanyl]isothiazole-4-carboxylic acid CAS Name: 5-[[(2-methylpropylamino)-oxomethyl]amino]-3-[(5-methyl-2-thiophenyl)methylthio]-4-isothiazolecarboxylic acid IUPAC Name: 5-(2-methylpropylcarbamoylamino)-3-[(5-methylthiophen-2-yl)methylsulfanyl]-1,2-thiazole-4-carboxylic acid Traditional Name: 5-(isobutylcarbamoylamino)-3-[(5-methyl-2-thienyl)methylthio]isothiazole-4-carboxylic acid Formula: C15H19N3O3S3 MolecularWeight: 385.52466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CSC2=NSC(=C2C(=O)O)NC(=O)NCC(C)C

Isomeric SMILES

CC1=CC=C(S1)CSC2=NSC(=C2C(=O)O)NC(=O)NCC(C)C

InChI

InChI=1S/C15H19N3O3S3/c1-8(2)6-16-15(21)17-12-11(14(19)20)13(18-24-12)22-7-10-5-4-9(3)23-10/h4-5,8H,6-7H2,1-3H3,(H,19,20)(H2,16,17,21)