N-cyclohexyl-2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-methyl-benzamide

Systemtic Name: N-cyclohexyl-2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-methyl-benzamide Openeye Name: N-cyclohexyl-2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-methyl-benzamide CAS Name: N-cyclohexyl-2-[[[[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-methylbenzamide IUPAC Name: N-cyclohexyl-2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioylamino]-N-methylbenzamide Traditional Name: N-cyclohexyl-2-[[(E)-3-(3,4-dimethoxyphenyl)acryloyl]thiocarbamoylamino]-N-methyl-benzamide Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)C=CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(C1CCCCC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)/C=C/C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C26H31N3O4S/c1-29(19-9-5-4-6-10-19)25(31)20-11-7-8-12-21(20)27-26(34)28-24(30)16-14-18-13-15-22(32-2)23(17-18)33-3/h7-8,11-17,19H,4-6,9-10H2,1-3H3,(H2,27,28,30,34)/b16-14+