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

Systemtic Name: N-[3-[(S)-(3-methoxyphenyl)-phenylazanyl-methyl]-4,5-dimethyl-thiophen-2-yl]benzamide Openeye Name: N-[3-[(S)-anilino-(3-methoxyphenyl)methyl]-4,5-dimethyl-2-thienyl]benzamide CAS Name: N-[3-[(S)-anilino-(3-methoxyphenyl)methyl]-4,5-dimethyl-2-thiophenyl]benzamide IUPAC Name: N-[3-[(S)-anilino-(3-methoxyphenyl)methyl]-4,5-dimethylthiophen-2-yl]benzamide Traditional Name: N-[3-[(S)-anilino-(3-methoxyphenyl)methyl]-4,5-dimethyl-2-thienyl]benzamide Formula: C27H26N2O2S MolecularWeight: 442.57254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26N2O2S/c1-18-19(2)32-27(29-26(30)20-11-6-4-7-12-20)24(18)25(28-22-14-8-5-9-15-22)21-13-10-16-23(17-21)31-3/h4-17,25,28H,1-3H3,(H,29,30)/t25-/m0/s1