2-[(3,4-dimethylphenyl)carbamoyl-prop-2-enyl-amino]-N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(3,4-dimethylphenyl)carbamoyl-prop-2-enyl-amino]-N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: 2-[allyl-[(3,4-dimethylphenyl)carbamoyl]amino]-N-benzyl-N-[(5-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[[(3,4-dimethylanilino)-oxomethyl]-prop-2-enylamino]-N-[(5-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(3,4-dimethylphenyl)carbamoyl-prop-2-enylamino]-N-[(5-methylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[allyl-[(3,4-dimethylphenyl)carbamoyl]amino]-N-benzyl-N-[(5-methyl-2-thienyl)methyl]acetamide Formula: C27H31N3O2S MolecularWeight: 461.61894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N(CC=C)CC(=O)N(CC2=CC=CC=C2)CC3=CC=C(S3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N(CC=C)CC(=O)N(CC2=CC=CC=C2)CC3=CC=C(S3)C)C

InChI

InChI=1S/C27H31N3O2S/c1-5-15-29(27(32)28-24-13-11-20(2)21(3)16-24)19-26(31)30(17-23-9-7-6-8-10-23)18-25-14-12-22(4)33-25/h5-14,16H,1,15,17-19H2,2-4H3,(H,28,32)