N-[3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-propyl]-1-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-propyl]-1-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-ylamino)-3-oxo-propyl]-1-(4-methoxyphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-ylamino)-3-oxopropyl]-1-(4-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-ylamino)-3-oxopropyl]-1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-ylamino)-3-keto-propyl]-5-keto-1-(4-methoxyphenyl)pyrrolidine-3-carboxamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCCC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NCCC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H22N4O4S/c1-30-16-8-6-15(7-9-16)26-13-14(12-20(26)28)21(29)23-11-10-19(27)25-22-24-17-4-2-3-5-18(17)31-22/h2-9,14H,10-13H2,1H3,(H,23,29)(H,24,25,27)