N-[3-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]-2-methyl-phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]-2-methyl-phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]-2-methyl-phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[[[(E)-3-(4-ethoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-2-methylphenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[(E)-3-(4-ethoxyphenyl)prop-2-enoyl]carbamothioylamino]-2-methylphenyl]cyclopropanecarboxamide Traditional Name: N-[2-methyl-3-[[(E)-3-p-phenetylacryloyl]thiocarbamoylamino]phenyl]cyclopropanecarboxamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=CC(=C2C)NC(=O)C3CC3

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC=CC(=C2C)NC(=O)C3CC3

InChI

InChI=1S/C23H25N3O3S/c1-3-29-18-12-7-16(8-13-18)9-14-21(27)26-23(30)25-20-6-4-5-19(15(20)2)24-22(28)17-10-11-17/h4-9,12-14,17H,3,10-11H2,1-2H3,(H,24,28)(H2,25,26,27,30)/b14-9+