3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-[(5-chloranylthiophen-2-yl)methyl]-N-prop-2-enyl-propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-[(5-chloranylthiophen-2-yl)methyl]-N-prop-2-enyl-propanamide Openeye Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-prop-2-enylpropanamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-prop-2-enylpropanamide Traditional Name: N-allyl-N-[(5-chloro-2-thienyl)methyl]-3-(1,3-diketo-4H-isoquinolin-2-yl)propionamide Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=C(S1)Cl)C(=O)CCN2C(=O)CC3=CC=CC=C3C2=O

Isomeric SMILES

C=CCN(CC1=CC=C(S1)Cl)C(=O)CCN2C(=O)CC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H19ClN2O3S/c1-2-10-22(13-15-7-8-17(21)27-15)18(24)9-11-23-19(25)12-14-5-3-4-6-16(14)20(23)26/h2-8H,1,9-13H2