2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrol-2-yl]ethanamide

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrol-2-yl]ethanamide Openeye Name: 2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-N-[3-cyano-1-(2-furylmethyl)-4,5-dimethyl-pyrrol-2-yl]acetamide CAS Name: 2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]-N-[3-cyano-1-(2-furanylmethyl)-4,5-dimethyl-2-pyrrolyl]acetamide IUPAC Name: 2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]-N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethylpyrrol-2-yl]acetamide Traditional Name: 2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-N-[3-cyano-1-(2-furfuryl)-4,5-dimethyl-pyrrol-2-yl]acetamide Formula: C22H23ClN4O2S MolecularWeight: 442.96162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN(CC=C)CC2=CC=C(S2)Cl)CC3=CC=CO3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN(CC=C)CC2=CC=C(S2)Cl)CC3=CC=CO3)C

InChI

InChI=1S/C22H23ClN4O2S/c1-4-9-26(13-18-7-8-20(23)30-18)14-21(28)25-22-19(11-24)15(2)16(3)27(22)12-17-6-5-10-29-17/h4-8,10H,1,9,12-14H2,2-3H3,(H,25,28)