2-bromanyl-N-[1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-bromo-N-[1-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-bromo-N-[1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-bromo-N-[1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-bromo-N-[1-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]-3-(methylthio)propyl]benzamide Formula: C20H20BrN3O2S2 MolecularWeight: 478.4257

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CCSC)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CCSC)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C20H20BrN3O2S2/c1-12-7-8-15-17(11-12)28-20(23-15)24-19(26)16(9-10-27-2)22-18(25)13-5-3-4-6-14(13)21/h3-8,11,16H,9-10H2,1-2H3,(H,22,25)(H,23,24,26)