N-(4-methoxyphenyl)-2-(7-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-(4-methoxyphenyl)-2-(7-methyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-(4-methoxyphenyl)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-(4-methoxyphenyl)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)propanamide IUPAC Name: N-(4-methoxyphenyl)-2-(7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: 2-(4-keto-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propionamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC3=C2C(=O)N(C=N3)C(C)C(=O)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1CCC2=C(C1)SC3=C2C(=O)N(C=N3)C(C)C(=O)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C21H23N3O3S/c1-12-4-9-16-17(10-12)28-20-18(16)21(26)24(11-22-20)13(2)19(25)23-14-5-7-15(27-3)8-6-14/h5-8,11-13H,4,9-10H2,1-3H3,(H,23,25)