4-butoxy-N-[4-[2-[(3-methylphenyl)amino]-1,3-thiazol-4-yl]phenyl]benzamide

Systemtic Name: 4-butoxy-N-[4-[2-[(3-methylphenyl)amino]-1,3-thiazol-4-yl]phenyl]benzamide Openeye Name: 4-butoxy-N-[4-[2-(3-methylanilino)thiazol-4-yl]phenyl]benzamide CAS Name: 4-butoxy-N-[4-[2-(3-methylanilino)-4-thiazolyl]phenyl]benzamide IUPAC Name: 4-butoxy-N-[4-[2-(3-methylanilino)-1,3-thiazol-4-yl]phenyl]benzamide Traditional Name: 4-butoxy-N-[4-[2-(m-toluidino)thiazol-4-yl]phenyl]benzamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=CSC(=N3)NC4=CC=CC(=C4)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=CSC(=N3)NC4=CC=CC(=C4)C

InChI

InChI=1S/C27H27N3O2S/c1-3-4-16-32-24-14-10-21(11-15-24)26(31)28-22-12-8-20(9-13-22)25-18-33-27(30-25)29-23-7-5-6-19(2)17-23/h5-15,17-18H,3-4,16H2,1-2H3,(H,28,31)(H,29,30)