(7S)-2-[(Z)-1-chloranyl-2-pyridin-3-yl-ethenyl]-7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: (7S)-2-[(Z)-1-chloranyl-2-pyridin-3-yl-ethenyl]-7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: (7S)-2-[(Z)-1-chloro-2-(3-pyridyl)vinyl]-7-methyl-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: (7S)-2-[(Z)-1-chloro-2-(3-pyridinyl)ethenyl]-7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: (7S)-2-[(Z)-1-chloro-2-pyridin-3-ylethenyl]-7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: (7S)-2-[(Z)-1-chloro-2-(3-pyridyl)vinyl]-7-methyl-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C18H16ClN3OS MolecularWeight: 357.85714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC3=C2C(=O)NC(=N3)C(=CC4=CN=CC=C4)Cl

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC3=C2C(=O)NC(=N3)/C(=C/C4=CN=CC=C4)/Cl

InChI

InChI=1S/C18H16ClN3OS/c1-10-4-5-12-14(7-10)24-18-15(12)17(23)21-16(22-18)13(19)8-11-3-2-6-20-9-11/h2-3,6,8-10H,4-5,7H2,1H3,(H,21,22,23)/b13-8-/t10-/m0/s1