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

Systemtic Name: N-[(2S)-2-azanyl-2-phenyl-ethyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide Openeye Name: N-[(2S)-2-amino-2-phenyl-ethyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide CAS Name: N-[(2S)-2-amino-2-phenylethyl]-5-[2-(methylamino)-4-pyrimidinyl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-2-amino-2-phenylethyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide Traditional Name: N-[(2S)-2-amino-2-phenyl-ethyl]-5-[2-(methylamino)pyrimidin-4-yl]thiophene-2-carboxamide Formula: C18H19N5OS MolecularWeight: 353.44136

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=CC(=N1)C2=CC=C(S2)C(=O)NCC(C3=CC=CC=C3)N

Isomeric SMILES

CNC1=NC=CC(=N1)C2=CC=C(S2)C(=O)NC[C@H](C3=CC=CC=C3)N

InChI

InChI=1S/C18H19N5OS/c1-20-18-21-10-9-14(23-18)15-7-8-16(25-15)17(24)22-11-13(19)12-5-3-2-4-6-12/h2-10,13H,11,19H2,1H3,(H,22,24)(H,20,21,23)/t13-/m1/s1