4-bromanyl-N-[4-[2-[3-(cyclohexylamino)propylamino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-bromanyl-N-[4-[2-[3-(cyclohexylamino)propylamino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]benzamide Openeye Name: 4-bromo-N-[4-[2-[3-(cyclohexylamino)propylamino]-2-oxo-ethyl]thiazol-2-yl]benzamide CAS Name: 4-bromo-N-[4-[2-[3-(cyclohexylamino)propylamino]-2-oxoethyl]-2-thiazolyl]benzamide IUPAC Name: 4-bromo-N-[4-[2-[3-(cyclohexylamino)propylamino]-2-oxoethyl]-1,3-thiazol-2-yl]benzamide Traditional Name: 4-bromo-N-[4-[2-[3-(cyclohexylamino)propylamino]-2-keto-ethyl]thiazol-2-yl]benzamide Formula: C21H27BrN4O2S MolecularWeight: 479.43368

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCCCNC(=O)CC2=CSC(=N2)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCC(CC1)NCCCNC(=O)CC2=CSC(=N2)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H27BrN4O2S/c22-16-9-7-15(8-10-16)20(28)26-21-25-18(14-29-21)13-19(27)24-12-4-11-23-17-5-2-1-3-6-17/h7-10,14,17,23H,1-6,11-13H2,(H,24,27)(H,25,26,28)