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

Systemtic Name: N-[4-[[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]carbamothioylamino]carbamoyl]phenyl]-3-methyl-benzamide Openeye Name: N-[4-[[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]carbamothioylamino]carbamoyl]phenyl]-3-methyl-benzamide CAS Name: N-[4-[[[[[(E)-3-(2-methoxyphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-3-methylbenzamide IUPAC Name: N-[4-[[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]carbamothioylamino]carbamoyl]phenyl]-3-methylbenzamide Traditional Name: N-[4-[[[(E)-3-(2-methoxyphenyl)acryloyl]thiocarbamoylamino]carbamoyl]phenyl]-3-methyl-benzamide Formula: C26H24N4O4S MolecularWeight: 488.55816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C=CC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)/C=C/C3=CC=CC=C3OC

InChI

InChI=1S/C26H24N4O4S/c1-17-6-5-8-20(16-17)24(32)27-21-13-10-19(11-14-21)25(33)29-30-26(35)28-23(31)15-12-18-7-3-4-9-22(18)34-2/h3-16H,1-2H3,(H,27,32)(H,29,33)(H2,28,30,31,35)/b15-12+