(2S)-N-(2-methoxyphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide

Systemtic Name: (2S)-N-(2-methoxyphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide Openeye Name: (2S)-N-(2-methoxyphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide CAS Name: (2S)-N-(2-methoxyphenyl)-2-[(6-phenyl-4-pyrimidinyl)thio]butanamide IUPAC Name: (2S)-N-(2-methoxyphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanylbutanamide Traditional Name: (2S)-N-(2-methoxyphenyl)-2-[(6-phenylpyrimidin-4-yl)thio]butyramide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1OC)SC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C(=O)NC1=CC=CC=C1OC)SC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-3-19(21(25)24-16-11-7-8-12-18(16)26-2)27-20-13-17(22-14-23-20)15-9-5-4-6-10-15/h4-14,19H,3H2,1-2H3,(H,24,25)/t19-/m0/s1