2-[(4-methylsulfanylphenyl)carbamoyl-propyl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(4-methylsulfanylphenyl)carbamoyl-propyl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-benzyl-2-[(4-methylsulfanylphenyl)carbamoyl-propyl-amino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[[4-(methylthio)anilino]-oxomethyl]-propylamino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-methylsulfanylphenyl)carbamoyl-propylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-benzyl-2-[[4-(methylthio)phenyl]carbamoyl-propyl-amino]-N-(2-thenyl)acetamide Formula: C25H29N3O2S2 MolecularWeight: 467.64666

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)NC3=CC=C(C=C3)SC

Isomeric SMILES

CCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C25H29N3O2S2/c1-3-15-27(25(30)26-21-11-13-22(31-2)14-12-21)19-24(29)28(18-23-10-7-16-32-23)17-20-8-5-4-6-9-20/h4-14,16H,3,15,17-19H2,1-2H3,(H,26,30)