N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-[(4-oxidanylidene-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-[(4-oxidanylidene-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: 2-[(3-allyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[5-[(2-chlorophenyl)methyl]thiazol-2-yl]acetamide CAS Name: N-[5-[(2-chlorophenyl)methyl]-2-thiazolyl]-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]acetamide IUPAC Name: N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-[(4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(3-allyl-4-keto-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)thio]-N-[5-(2-chlorobenzyl)thiazol-2-yl]acetamide Formula: C25H23ClN4O2S3 MolecularWeight: 543.12372

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCC(=O)NC3=NC=C(S3)CC4=CC=CC=C4Cl)SC5=C2CCCC5

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCC(=O)NC3=NC=C(S3)CC4=CC=CC=C4Cl)SC5=C2CCCC5

InChI

InChI=1S/C25H23ClN4O2S3/c1-2-11-30-23(32)21-17-8-4-6-10-19(17)35-22(21)29-25(30)33-14-20(31)28-24-27-13-16(34-24)12-15-7-3-5-9-18(15)26/h2-3,5,7,9,13H,1,4,6,8,10-12,14H2,(H,27,28,31)