2-(1-adamantyl)-N-[2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-2-oxo-ethyl]acetamide CAS Name: 2-(1-adamantyl)-N-[2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]-2-oxoethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]-2-oxoethyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-2-keto-ethyl]acetamide Formula: C22H29ClN2O2S MolecularWeight: 420.99586

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=C(S1)Cl)C(=O)CNC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C=CCN(CC1=CC=C(S1)Cl)C(=O)CNC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H29ClN2O2S/c1-2-5-25(14-18-3-4-19(23)28-18)21(27)13-24-20(26)12-22-9-15-6-16(10-22)8-17(7-15)11-22/h2-4,15-17H,1,5-14H2,(H,24,26)