N-[3-[(6-butyl-1,3-benzothiazol-2-yl)amino]-3-oxidanylidene-propyl]-2-methyl-benzamide

Systemtic Name: N-[3-[(6-butyl-1,3-benzothiazol-2-yl)amino]-3-oxidanylidene-propyl]-2-methyl-benzamide Openeye Name: N-[3-[(6-butyl-1,3-benzothiazol-2-yl)amino]-3-oxo-propyl]-2-methyl-benzamide CAS Name: N-[3-[(6-butyl-1,3-benzothiazol-2-yl)amino]-3-oxopropyl]-2-methylbenzamide IUPAC Name: N-[3-[(6-butyl-1,3-benzothiazol-2-yl)amino]-3-oxopropyl]-2-methylbenzamide Traditional Name: N-[3-[(6-butyl-1,3-benzothiazol-2-yl)amino]-3-keto-propyl]-2-methyl-benzamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNC(=O)C3=CC=CC=C3C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C22H25N3O2S/c1-3-4-8-16-10-11-18-19(14-16)28-22(24-18)25-20(26)12-13-23-21(27)17-9-6-5-7-15(17)2/h5-7,9-11,14H,3-4,8,12-13H2,1-2H3,(H,23,27)(H,24,25,26)