5-(5-methylfuran-2-yl)-2-(2-oxidanylidene-4-phenylazanyl-butyl)sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(5-methylfuran-2-yl)-2-(2-oxidanylidene-4-phenylazanyl-butyl)sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(4-anilino-2-oxo-butyl)sulfanyl-5-(5-methyl-2-furyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(4-anilino-2-oxobutyl)thio]-5-(5-methyl-2-furanyl)-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-(4-anilino-2-oxobutyl)sulfanyl-5-(5-methylfuran-2-yl)-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(4-anilino-2-keto-butyl)thio]-5-(5-methyl-2-furyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C27H23N3O3S2 MolecularWeight: 501.61982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)CCNC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(O1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)CCNC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H23N3O3S2/c1-18-12-13-23(33-18)22-17-34-25-24(22)26(32)30(20-10-6-3-7-11-20)27(29-25)35-16-21(31)14-15-28-19-8-4-2-5-9-19/h2-13,17,28H,14-16H2,1H3