5-[(4-acetamidophenyl)carbonylamino]-2-[(4-dimethylaminophenyl)amino]-1,3-thiazole-4-carboxamide

Systemtic Name: 5-[(4-acetamidophenyl)carbonylamino]-2-[(4-dimethylaminophenyl)amino]-1,3-thiazole-4-carboxamide Openeye Name: 5-[(4-acetamidobenzoyl)amino]-2-[4-(dimethylamino)anilino]thiazole-4-carboxamide CAS Name: 5-[[(4-acetamidophenyl)-oxomethyl]amino]-2-[4-(dimethylamino)anilino]-4-thiazolecarboxamide IUPAC Name: 5-[(4-acetamidobenzoyl)amino]-2-[4-(dimethylamino)anilino]-1,3-thiazole-4-carboxamide Traditional Name: 5-[(4-acetamidobenzoyl)amino]-2-[4-(dimethylamino)anilino]thiazole-4-carboxamide Formula: C21H22N6O3S MolecularWeight: 438.50278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NC2=C(N=C(S2)NC3=CC=C(C=C3)N(C)C)C(=O)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)NC2=C(N=C(S2)NC3=CC=C(C=C3)N(C)C)C(=O)N

InChI

InChI=1S/C21H22N6O3S/c1-12(28)23-14-6-4-13(5-7-14)19(30)26-20-17(18(22)29)25-21(31-20)24-15-8-10-16(11-9-15)27(2)3/h4-11H,1-3H3,(H2,22,29)(H,23,28)(H,24,25)(H,26,30)