N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide

Systemtic Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxamide Openeye Name: 2-allyl-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1,3-dioxo-2-prop-2-enyl-5-isoindolecarboxamide IUPAC Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-1,3-dioxo-2-prop-2-enylisoindole-5-carboxamide Traditional Name: 2-allyl-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-1,3-diketo-isoindoline-5-carboxamide Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

Isomeric SMILES

CC(C)CC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

InChI

InChI=1S/C18H18N4O3S/c1-4-7-22-16(24)12-6-5-11(9-13(12)17(22)25)15(23)19-18-21-20-14(26-18)8-10(2)3/h4-6,9-10H,1,7-8H2,2-3H3,(H,19,21,23)