2-azanyl-2-[4-[[4-(3-methylthiophen-2-yl)pyrimidin-2-yl]amino]phenyl]sulfonyl-3H-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-azanyl-2-[4-[[4-(3-methylthiophen-2-yl)pyrimidin-2-yl]amino]phenyl]sulfonyl-3H-1,3-thiazole-4-carboxylic acid Openeye Name: 2-amino-2-[4-[[4-(3-methyl-2-thienyl)pyrimidin-2-yl]amino]phenyl]sulfonyl-3H-thiazole-4-carboxylic acid CAS Name: 2-amino-2-[4-[[4-(3-methyl-2-thiophenyl)-2-pyrimidinyl]amino]phenyl]sulfonyl-3H-thiazole-4-carboxylic acid IUPAC Name: 2-amino-2-[4-[[4-(3-methylthiophen-2-yl)pyrimidin-2-yl]amino]phenyl]sulfonyl-3H-1,3-thiazole-4-carboxylic acid Traditional Name: 2-amino-2-[4-[[4-(3-methyl-2-thienyl)pyrimidin-2-yl]amino]phenyl]sulfonyl-4-thiazoline-4-carboxylic acid Formula: C19H17N5O4S3 MolecularWeight: 475.56438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2=NC(=NC=C2)NC3=CC=C(C=C3)S(=O)(=O)C4(NC(=CS4)C(=O)O)N

Isomeric SMILES

CC1=C(SC=C1)C2=NC(=NC=C2)NC3=CC=C(C=C3)S(=O)(=O)C4(NC(=CS4)C(=O)O)N

InChI

InChI=1S/C19H17N5O4S3/c1-11-7-9-29-16(11)14-6-8-21-18(23-14)22-12-2-4-13(5-3-12)31(27,28)19(20)24-15(10-30-19)17(25)26/h2-10,24H,20H2,1H3,(H,25,26)(H,21,22,23)