3-[2-[(6-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]ethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 3-[2-[(6-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]ethanoylamino]-N,N-diethyl-benzamide Openeye Name: 3-[[2-[(6-chloro-1,3-benzoxazol-2-yl)sulfanyl]acetyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[2-[(6-chloro-1,3-benzoxazol-2-yl)thio]-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[2-[(6-chloro-1,3-benzoxazol-2-yl)sulfanyl]acetyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[2-[(6-chloro-1,3-benzoxazol-2-yl)thio]acetyl]amino]-N,N-diethyl-benzamide Formula: C20H20ClN3O3S MolecularWeight: 417.9091

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=C(O2)C=C(C=C3)Cl

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=C(O2)C=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3O3S/c1-3-24(4-2)19(26)13-6-5-7-15(10-13)22-18(25)12-28-20-23-16-9-8-14(21)11-17(16)27-20/h5-11H,3-4,12H2,1-2H3,(H,22,25)