4-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-oxidanylidene-[1]benzothiolo[3,2-d]pyrimidin-3-yl]-N-cyclopentyl-butanamide

Systemtic Name: 4-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-oxidanylidene-[1]benzothiolo[3,2-d]pyrimidin-3-yl]-N-cyclopentyl-butanamide Openeye Name: 4-[2-(2-amino-2-oxo-ethyl)sulfanyl-4-oxo-benzothiopheno[3,2-d]pyrimidin-3-yl]-N-cyclopentyl-butanamide CAS Name: 4-[2-[(2-amino-2-oxoethyl)thio]-4-oxo-[1]benzothiolo[3,2-d]pyrimidin-3-yl]-N-cyclopentylbutanamide IUPAC Name: 4-[2-(2-amino-2-oxoethyl)sulfanyl-4-oxo-[1]benzothiolo[3,2-d]pyrimidin-3-yl]-N-cyclopentylbutanamide Traditional Name: 4-[2-[(2-amino-2-keto-ethyl)thio]-4-keto-benzothiopheno[3,2-d]pyrimidin-3-yl]-N-cyclopentyl-butyramide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)CCCN2C(=O)C3=C(C4=CC=CC=C4S3)N=C2SCC(=O)N

Isomeric SMILES

C1CCC(C1)NC(=O)CCCN2C(=O)C3=C(C4=CC=CC=C4S3)N=C2SCC(=O)N

InChI

InChI=1S/C21H24N4O3S2/c22-16(26)12-29-21-24-18-14-8-3-4-9-15(14)30-19(18)20(28)25(21)11-5-10-17(27)23-13-6-1-2-7-13/h3-4,8-9,13H,1-2,5-7,10-12H2,(H2,22,26)(H,23,27)