4-chloranyl-N-[4-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-4-oxidanylidene-butyl]benzamide

Systemtic Name: 4-chloranyl-N-[4-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-4-oxidanylidene-butyl]benzamide Openeye Name: 4-chloro-N-[4-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-4-oxo-butyl]benzamide CAS Name: 4-chloro-N-[4-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-4-oxobutyl]benzamide IUPAC Name: 4-chloro-N-[4-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-4-oxobutyl]benzamide Traditional Name: 4-chloro-N-[4-[(5,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-4-keto-butyl]benzamide Formula: C20H20ClN3O4S MolecularWeight: 433.9085

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(S2)NC(=O)CCCNC(=O)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(S2)NC(=O)CCCNC(=O)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C20H20ClN3O4S/c1-27-15-10-14-17(11-16(15)28-2)29-20(23-14)24-18(25)4-3-9-22-19(26)12-5-7-13(21)8-6-12/h5-8,10-11H,3-4,9H2,1-2H3,(H,22,26)(H,23,24,25)