N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-1-(1,3-benzodioxol-5-yl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-1-(1,3-benzodioxol-5-yl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-1-(1,3-benzodioxol-5-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-1-(1,3-benzodioxol-5-yl)-5-keto-pyrrolidine-3-carboxamide Formula: C18H18N4O5S2 MolecularWeight: 434.48932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCO4)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCO4)SCC(=O)N

InChI

InChI=1S/C18H18N4O5S2/c1-9-17(28-7-14(19)23)29-18(20-9)21-16(25)10-4-15(24)22(6-10)11-2-3-12-13(5-11)27-8-26-12/h2-3,5,10H,4,6-8H2,1H3,(H2,19,23)(H,20,21,25)