N-[4-[3-(furan-2-yl)prop-2-enoylcarbamothioylamino]-2-methoxy-phenyl]pentanamide

Systemtic Name: N-[4-[3-(furan-2-yl)prop-2-enoylcarbamothioylamino]-2-methoxy-phenyl]pentanamide Openeye Name: N-[4-[3-(2-furyl)prop-2-enoylcarbamothioylamino]-2-methoxy-phenyl]pentanamide CAS Name: N-[4-[[[[3-(2-furanyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-2-methoxyphenyl]pentanamide IUPAC Name: N-[4-[3-(furan-2-yl)prop-2-enoylcarbamothioylamino]-2-methoxyphenyl]pentanamide Traditional Name: N-[4-[[3-(2-furyl)acryloyl]thiocarbamoylamino]-2-methoxy-phenyl]valeramide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)C=CC2=CC=CO2)OC

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)C=CC2=CC=CO2)OC

InChI

InChI=1S/C20H23N3O4S/c1-3-4-7-18(24)22-16-10-8-14(13-17(16)26-2)21-20(28)23-19(25)11-9-15-6-5-12-27-15/h5-6,8-13H,3-4,7H2,1-2H3,(H,22,24)(H2,21,23,25,28)