2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[3-[2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]pyrazolidin-1-yl]-3-oxidanylidene-propyl]ethanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[3-[2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]pyrazolidin-1-yl]-3-oxidanylidene-propyl]ethanamide Openeye Name: N-[3-[2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]pyrazolidin-1-yl]-3-oxo-propyl]-2-(1,3-dioxoisoindolin-2-yl)acetamide CAS Name: N-[3-[2-[[2-(1-cyclohexenyl)ethylamino]-sulfanylidenemethyl]-1-pyrazolidinyl]-3-oxopropyl]-2-(1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-[3-[2-[2-(cyclohexen-1-yl)ethylcarbamothioyl]pyrazolidin-1-yl]-3-oxopropyl]-2-(1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-[3-[2-[2-(cyclohexen-1-yl)ethylthiocarbamoyl]pyrazolidin-1-yl]-3-keto-propyl]-2-phthalimido-acetamide Formula: C25H31N5O4S MolecularWeight: 497.60974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=S)N2CCCN2C(=O)CCNC(=O)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CCC(=CC1)CCNC(=S)N2CCCN2C(=O)CCNC(=O)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H31N5O4S/c31-21(17-28-23(33)19-9-4-5-10-20(19)24(28)34)26-14-12-22(32)29-15-6-16-30(29)25(35)27-13-11-18-7-2-1-3-8-18/h4-5,7,9-10H,1-3,6,8,11-17H2,(H,26,31)(H,27,35)