2-[3-(3-methylbutyl)-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl]sulfanylpropanamide

Systemtic Name: 2-[3-(3-methylbutyl)-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl]sulfanylpropanamide Openeye Name: 2-[3-isopentyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]sulfanylpropanamide CAS Name: 2-[[3-(3-methylbutyl)-4-oxo-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl]thio]propanamide IUPAC Name: 2-[3-(3-methylbutyl)-4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl]sulfanylpropanamide Traditional Name: 2-[[3-isoamyl-4-keto-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]thio]propionamide Formula: C18H21N3O2S3 MolecularWeight: 407.57324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(N=C1SC(C)C(=O)N)SC=C2C3=CC=CS3

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(N=C1SC(C)C(=O)N)SC=C2C3=CC=CS3

InChI

InChI=1S/C18H21N3O2S3/c1-10(2)6-7-21-17(23)14-12(13-5-4-8-24-13)9-25-16(14)20-18(21)26-11(3)15(19)22/h4-5,8-11H,6-7H2,1-3H3,(H2,19,22)