N-[4-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-5-oxidanylidene-pyrrolidine-2-carboxamide

Systemtic Name: N-[4-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-5-oxidanylidene-pyrrolidine-2-carboxamide Openeye Name: N-[4-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]thiazol-2-yl]-5-oxo-pyrrolidine-2-carboxamide CAS Name: N-[4-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-2-thiazolyl]-5-oxo-2-pyrrolidinecarboxamide IUPAC Name: N-[4-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]-5-oxopyrrolidine-2-carboxamide Traditional Name: N-[4-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]thiazol-2-yl]-5-keto-pyrrolidine-2-carboxamide Formula: C17H17BrN4O3S MolecularWeight: 437.31088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CC2=CSC(=N2)NC(=O)C3CCC(=O)N3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CC2=CSC(=N2)NC(=O)C3CCC(=O)N3

InChI

InChI=1S/C17H17BrN4O3S/c1-9-6-10(18)2-3-12(9)20-15(24)7-11-8-26-17(19-11)22-16(25)13-4-5-14(23)21-13/h2-3,6,8,13H,4-5,7H2,1H3,(H,20,24)(H,21,23)(H,19,22,25)