2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[5-hexyl-3-(2-methylphenyl)carbonyl-thiophen-2-yl]propanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[5-hexyl-3-(2-methylphenyl)carbonyl-thiophen-2-yl]propanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-[5-hexyl-3-(2-methylbenzoyl)-2-thienyl]propanamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-[5-hexyl-3-[(2-methylphenyl)-oxomethyl]-2-thiophenyl]propanamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-[5-hexyl-3-(2-methylbenzoyl)thiophen-2-yl]propanamide Traditional Name: N-(5-hexyl-3-o-toluoyl-2-thienyl)-2-phthalimido-propionamide Formula: C29H30N2O4S MolecularWeight: 502.6245

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(S1)NC(=O)C(C)N2C(=O)C3=CC=CC=C3C2=O)C(=O)C4=CC=CC=C4C

Isomeric SMILES

CCCCCCC1=CC(=C(S1)NC(=O)C(C)N2C(=O)C3=CC=CC=C3C2=O)C(=O)C4=CC=CC=C4C

InChI

InChI=1S/C29H30N2O4S/c1-4-5-6-7-13-20-17-24(25(32)21-14-9-8-12-18(21)2)27(36-20)30-26(33)19(3)31-28(34)22-15-10-11-16-23(22)29(31)35/h8-12,14-17,19H,4-7,13H2,1-3H3,(H,30,33)