N-[4,5-dimethyl-3-[(S)-phenylazanyl(pyridin-4-yl)methyl]thiophen-2-yl]benzamide

Systemtic Name: N-[4,5-dimethyl-3-[(S)-phenylazanyl(pyridin-4-yl)methyl]thiophen-2-yl]benzamide Openeye Name: N-[3-[(S)-anilino(4-pyridyl)methyl]-4,5-dimethyl-2-thienyl]benzamide CAS Name: N-[3-[(S)-anilino(pyridin-4-yl)methyl]-4,5-dimethyl-2-thiophenyl]benzamide IUPAC Name: N-[3-[(S)-anilino(pyridin-4-yl)methyl]-4,5-dimethylthiophen-2-yl]benzamide Traditional Name: N-[3-[(S)-anilino(4-pyridyl)methyl]-4,5-dimethyl-2-thienyl]benzamide Formula: C25H23N3OS MolecularWeight: 413.53462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(C2=CC=NC=C2)NC3=CC=CC=C3)NC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1[C@H](C2=CC=NC=C2)NC3=CC=CC=C3)NC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H23N3OS/c1-17-18(2)30-25(28-24(29)20-9-5-3-6-10-20)22(17)23(19-13-15-26-16-14-19)27-21-11-7-4-8-12-21/h3-16,23,27H,1-2H3,(H,28,29)/t23-/m0/s1