N-[3-[methyl(phenyl)amino]propyl]-4-(quinolin-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-[3-[methyl(phenyl)amino]propyl]-4-(quinolin-2-ylsulfanylmethyl)benzamide Openeye Name: N-[3-(N-methylanilino)propyl]-4-(2-quinolylsulfanylmethyl)benzamide CAS Name: N-[3-(N-methylanilino)propyl]-4-[(2-quinolinylthio)methyl]benzamide IUPAC Name: N-[3-(N-methylanilino)propyl]-4-(quinolin-2-ylsulfanylmethyl)benzamide Traditional Name: N-[3-(N-methylanilino)propyl]-4-[(2-quinolylthio)methyl]benzamide Formula: C27H27N3OS MolecularWeight: 441.58778

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C=C2)C4=CC=CC=C4

Isomeric SMILES

CN(CCCNC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C=C2)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3OS/c1-30(24-9-3-2-4-10-24)19-7-18-28-27(31)23-14-12-21(13-15-23)20-32-26-17-16-22-8-5-6-11-25(22)29-26/h2-6,8-17H,7,18-20H2,1H3,(H,28,31)