N-[(2S)-2-azanyl-2-phenyl-ethyl]-5-(2-azanylpyrimidin-4-yl)thiophene-2-carboxamide

Systemtic Name: N-[(2S)-2-azanyl-2-phenyl-ethyl]-5-(2-azanylpyrimidin-4-yl)thiophene-2-carboxamide Openeye Name: N-[(2S)-2-amino-2-phenyl-ethyl]-5-(2-aminopyrimidin-4-yl)thiophene-2-carboxamide CAS Name: N-[(2S)-2-amino-2-phenylethyl]-5-(2-amino-4-pyrimidinyl)-2-thiophenecarboxamide IUPAC Name: N-[(2S)-2-amino-2-phenylethyl]-5-(2-aminopyrimidin-4-yl)thiophene-2-carboxamide Traditional Name: N-[(2S)-2-amino-2-phenyl-ethyl]-5-(2-aminopyrimidin-4-yl)thiophene-2-carboxamide Formula: C17H17N5OS MolecularWeight: 339.41478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC(=O)C2=CC=C(S2)C3=NC(=NC=C3)N)N

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](CNC(=O)C2=CC=C(S2)C3=NC(=NC=C3)N)N

InChI

InChI=1S/C17H17N5OS/c18-12(11-4-2-1-3-5-11)10-21-16(23)15-7-6-14(24-15)13-8-9-20-17(19)22-13/h1-9,12H,10,18H2,(H,21,23)(H2,19,20,22)/t12-/m1/s1