(6S)-2-azanyl-6-methyl-6-[4-(3-prop-1-ynylphenyl)thiophen-2-yl]-3-(1,3-thiazol-2-ylmethyl)-5H-pyrimidin-4-one

Systemtic Name: (6S)-2-azanyl-6-methyl-6-[4-(3-prop-1-ynylphenyl)thiophen-2-yl]-3-(1,3-thiazol-2-ylmethyl)-5H-pyrimidin-4-one Openeye Name: (6S)-2-amino-6-methyl-6-[4-(3-prop-1-ynylphenyl)-2-thienyl]-3-(thiazol-2-ylmethyl)-5H-pyrimidin-4-one CAS Name: (6S)-2-amino-6-methyl-6-[4-(3-prop-1-ynylphenyl)-2-thiophenyl]-3-(2-thiazolylmethyl)-5H-pyrimidin-4-one IUPAC Name: (6S)-2-amino-6-methyl-6-[4-(3-prop-1-ynylphenyl)thiophen-2-yl]-3-(1,3-thiazol-2-ylmethyl)-5H-pyrimidin-4-one Traditional Name: (6S)-2-amino-6-methyl-6-[4-(3-prop-1-ynylphenyl)-2-thienyl]-3-(thiazol-2-ylmethyl)-5H-pyrimidin-4-one Formula: C22H20N4OS2 MolecularWeight: 420.5504

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC(=CC=C1)C2=CSC(=C2)C3(CC(=O)N(C(=N3)N)CC4=NC=CS4)C

Isomeric SMILES

CC#CC1=CC(=CC=C1)C2=CSC(=C2)[C@@]3(CC(=O)N(C(=N3)N)CC4=NC=CS4)C

InChI

InChI=1S/C22H20N4OS2/c1-3-5-15-6-4-7-16(10-15)17-11-18(29-14-17)22(2)12-20(27)26(21(23)25-22)13-19-24-8-9-28-19/h4,6-11,14H,12-13H2,1-2H3,(H2,23,25)/t22-/m0/s1