(6S)-2-azanyl-6-[4-(1,3-benzodioxol-5-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one

Systemtic Name: (6S)-2-azanyl-6-[4-(1,3-benzodioxol-5-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one Openeye Name: (6S)-2-amino-6-[4-(1,3-benzodioxol-5-yl)-2-thienyl]-3,6-dimethyl-5H-pyrimidin-4-one CAS Name: (6S)-2-amino-6-[4-(1,3-benzodioxol-5-yl)-2-thiophenyl]-3,6-dimethyl-5H-pyrimidin-4-one IUPAC Name: (6S)-2-amino-6-[4-(1,3-benzodioxol-5-yl)thiophen-2-yl]-3,6-dimethyl-5H-pyrimidin-4-one Traditional Name: (6S)-2-amino-6-[4-(1,3-benzodioxol-5-yl)-2-thienyl]-3,6-dimethyl-5H-pyrimidin-4-one Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)N(C(=N1)N)C)C2=CC(=CS2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@]1(CC(=O)N(C(=N1)N)C)C2=CC(=CS2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H17N3O3S/c1-17(7-15(21)20(2)16(18)19-17)14-6-11(8-24-14)10-3-4-12-13(5-10)23-9-22-12/h3-6,8H,7,9H2,1-2H3,(H2,18,19)/t17-/m0/s1