3-[(4-heptoxyphenyl)carbonylcarbamothioylamino]-N-methyl-benzamide

Systemtic Name: 3-[(4-heptoxyphenyl)carbonylcarbamothioylamino]-N-methyl-benzamide Openeye Name: 3-[(4-heptoxybenzoyl)carbamothioylamino]-N-methyl-benzamide CAS Name: 3-[[[[(4-heptoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-methylbenzamide IUPAC Name: 3-[(4-heptoxybenzoyl)carbamothioylamino]-N-methylbenzamide Traditional Name: 3-[(4-heptoxybenzoyl)thiocarbamoylamino]-N-methyl-benzamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC

InChI

InChI=1S/C23H29N3O3S/c1-3-4-5-6-7-15-29-20-13-11-17(12-14-20)22(28)26-23(30)25-19-10-8-9-18(16-19)21(27)24-2/h8-14,16H,3-7,15H2,1-2H3,(H,24,27)(H2,25,26,28,30)