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

Systemtic Name: N-[1-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide Openeye Name: N-[1-[(6-ethyl-1,3-benzothiazol-2-yl)carbamoyl]-3-methylsulfanyl-propyl]-2-methoxy-benzamide CAS Name: N-[1-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-4-(methylthio)-1-oxobutan-2-yl]-2-methoxybenzamide IUPAC Name: N-[1-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-4-methylsulfanyl-1-oxobutan-2-yl]-2-methoxybenzamide Traditional Name: N-[1-[(6-ethyl-1,3-benzothiazol-2-yl)carbamoyl]-3-(methylthio)propyl]-2-methoxy-benzamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CCSC)NC(=O)C3=CC=CC=C3OC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CCSC)NC(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C22H25N3O3S2/c1-4-14-9-10-16-19(13-14)30-22(24-16)25-21(27)17(11-12-29-3)23-20(26)15-7-5-6-8-18(15)28-2/h5-10,13,17H,4,11-12H2,1-3H3,(H,23,26)(H,24,25,27)