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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)NC2=CC3=C(C=C2)N=C(S3)SC

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)NC2=CC3=C(C=C2)N=C(S3)SC

InChI

InChI=1S/C22H25N3O3S2/c1-5-28-17-9-7-6-8-15(17)20(26)25-19(13(2)3)21(27)23-14-10-11-16-18(12-14)30-22(24-16)29-4/h6-13,19H,5H2,1-4H3,(H,23,27)(H,25,26)