N-[[4-(4-heptoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide

Systemtic Name: N-[[4-(4-heptoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide Openeye Name: N-[[4-(4-heptoxyphenyl)thiazol-2-yl]carbamothioyl]benzamide CAS Name: N-[[[4-(4-heptoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[4-(4-heptoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide Traditional Name: N-[[4-(4-heptoxyphenyl)thiazol-2-yl]thiocarbamoyl]benzamide Formula: C24H27N3O2S2 MolecularWeight: 453.62008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H27N3O2S2/c1-2-3-4-5-9-16-29-20-14-12-18(13-15-20)21-17-31-24(25-21)27-23(30)26-22(28)19-10-7-6-8-11-19/h6-8,10-15,17H,2-5,9,16H2,1H3,(H2,25,26,27,28,30)