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

Systemtic Name: N-[4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-4-ethanoyl-piperazine-1-carboxamide Openeye Name: 4-acetyl-N-[4-[2-(4-bromo-3-methyl-anilino)-2-oxo-ethyl]thiazol-2-yl]piperazine-1-carboxamide CAS Name: 4-acetyl-N-[4-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-2-thiazolyl]-1-piperazinecarboxamide IUPAC Name: 4-acetyl-N-[4-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-1,3-thiazol-2-yl]piperazine-1-carboxamide Traditional Name: 4-acetyl-N-[4-[2-(4-bromo-3-methyl-anilino)-2-keto-ethyl]thiazol-2-yl]piperazine-1-carboxamide Formula: C19H22BrN5O3S MolecularWeight: 480.37868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CC2=CSC(=N2)NC(=O)N3CCN(CC3)C(=O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CC2=CSC(=N2)NC(=O)N3CCN(CC3)C(=O)C)Br

InChI

InChI=1S/C19H22BrN5O3S/c1-12-9-14(3-4-16(12)20)21-17(27)10-15-11-29-18(22-15)23-19(28)25-7-5-24(6-8-25)13(2)26/h3-4,9,11H,5-8,10H2,1-2H3,(H,21,27)(H,22,23,28)