N-[2-methoxy-4-[[(E)-3-(5-phenylfuran-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-methoxy-4-[[(E)-3-(5-phenylfuran-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[2-methoxy-4-[[(E)-3-(5-phenyl-2-furyl)prop-2-enoyl]carbamothioylamino]phenyl]thiophene-2-carboxamide CAS Name: N-[2-methoxy-4-[[[[(E)-1-oxo-3-(5-phenyl-2-furanyl)prop-2-enyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-methoxy-4-[[(E)-3-(5-phenylfuran-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-methoxy-4-[[(E)-3-(5-phenyl-2-furyl)acryloyl]thiocarbamoylamino]phenyl]thiophene-2-carboxamide Formula: C26H21N3O4S2 MolecularWeight: 503.59264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=S)NC(=O)C=CC2=CC=C(O2)C3=CC=CC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=S)NC(=O)/C=C/C2=CC=C(O2)C3=CC=CC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C26H21N3O4S2/c1-32-22-16-18(9-12-20(22)28-25(31)23-8-5-15-35-23)27-26(34)29-24(30)14-11-19-10-13-21(33-19)17-6-3-2-4-7-17/h2-16H,1H3,(H,28,31)(H2,27,29,30,34)/b14-11+