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

Systemtic Name: N-ethyl-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-phenyl-benzamide Openeye Name: N-ethyl-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-phenyl-benzamide CAS Name: N-ethyl-2-[[[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: N-ethyl-2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-phenylbenzamide Traditional Name: N-ethyl-2-[[(E)-3-(4-methoxyphenyl)acryloyl]thiocarbamoylamino]-N-phenyl-benzamide Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C=CC3=CC=C(C=C3)OC

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)/C=C/C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H25N3O3S/c1-3-29(20-9-5-4-6-10-20)25(31)22-11-7-8-12-23(22)27-26(33)28-24(30)18-15-19-13-16-21(32-2)17-14-19/h4-18H,3H2,1-2H3,(H2,27,28,30,33)/b18-15+