4-[[5,5-bis(oxidanylidene)-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-yl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide

Systemtic Name: 4-[[5,5-bis(oxidanylidene)-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-yl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-yl)amino]benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-yl)amino]benzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-yl)amino]benzamide Traditional Name: 4-[(5,5-diketo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-yl)amino]-N-homoveratryl-benzamide Formula: C22H25N3O5S2 MolecularWeight: 475.581

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)NC3=NC4CS(=O)(=O)CC4S3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)NC3=NC4CS(=O)(=O)CC4S3)OC

InChI

InChI=1S/C22H25N3O5S2/c1-29-18-8-3-14(11-19(18)30-2)9-10-23-21(26)15-4-6-16(7-5-15)24-22-25-17-12-32(27,28)13-20(17)31-22/h3-8,11,17,20H,9-10,12-13H2,1-2H3,(H,23,26)(H,24,25)