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

Systemtic Name: 2-chloranyl-N-[1-[(2-methyl-1,3-benzothiazol-6-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-chloro-N-[1-[(2-methyl-1,3-benzothiazol-6-yl)carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: 2-chloro-N-[1-[(2-methyl-1,3-benzothiazol-6-yl)amino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: 2-chloro-N-[1-[(2-methyl-1,3-benzothiazol-6-yl)amino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-chloro-N-[1-[(2-methyl-1,3-benzothiazol-6-yl)carbamoyl]-3-(methylthio)propyl]benzamide Formula: C20H20ClN3O2S2 MolecularWeight: 433.9747

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C(CCSC)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)C(CCSC)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H20ClN3O2S2/c1-12-22-16-8-7-13(11-18(16)28-12)23-20(26)17(9-10-27-2)24-19(25)14-5-3-4-6-15(14)21/h3-8,11,17H,9-10H2,1-2H3,(H,23,26)(H,24,25)