2-[butylcarbamoyl(prop-2-enyl)amino]-N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[butylcarbamoyl(prop-2-enyl)amino]-N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: 2-[allyl(butylcarbamoyl)amino]-N-benzyl-N-[(5-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[[butylamino(oxo)methyl]-prop-2-enylamino]-N-[(5-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[butylcarbamoyl(prop-2-enyl)amino]-N-[(5-methylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[allyl(butylcarbamoyl)amino]-N-benzyl-N-[(5-methyl-2-thienyl)methyl]acetamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(CC=C)CC(=O)N(CC1=CC=CC=C1)CC2=CC=C(S2)C

Isomeric SMILES

CCCCNC(=O)N(CC=C)CC(=O)N(CC1=CC=CC=C1)CC2=CC=C(S2)C

InChI

InChI=1S/C23H31N3O2S/c1-4-6-14-24-23(28)25(15-5-2)18-22(27)26(16-20-10-8-7-9-11-20)17-21-13-12-19(3)29-21/h5,7-13H,2,4,6,14-18H2,1,3H3,(H,24,28)