4-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-methyl-N-phenyl-benzamide

Systemtic Name: 4-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-methyl-N-phenyl-benzamide Openeye Name: 4-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-methyl-N-phenyl-benzamide CAS Name: 4-[[[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-methyl-N-phenylbenzamide IUPAC Name: 4-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-methyl-N-phenylbenzamide Traditional Name: 4-[[(E)-3-(4-methoxyphenyl)acryloyl]thiocarbamoylamino]-N-methyl-N-phenyl-benzamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=C(C=C3)OC

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)/C=C/C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H23N3O3S/c1-28(21-6-4-3-5-7-21)24(30)19-11-13-20(14-12-19)26-25(32)27-23(29)17-10-18-8-15-22(31-2)16-9-18/h3-17H,1-2H3,(H2,26,27,29,32)/b17-10+