N-(2-azanylethyl)-1-(4-methylphenyl)carbonyl-3-(phenylmethyl)sulfonyl-imidazolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(4-methylphenyl)carbonyl-3-(phenylmethyl)sulfonyl-imidazolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-(4-methylbenzoyl)imidazolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(4-methylphenyl)-oxomethyl]-3-(phenylmethyl)sulfonyl-2-imidazolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-(4-methylbenzoyl)imidazolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-p-toluoyl-imidazolidine-2-carboxamide Formula: C21H26N4O4S MolecularWeight: 430.52054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(C2C(=O)NCCN)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(C2C(=O)NCCN)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O4S/c1-16-7-9-18(10-8-16)21(27)24-13-14-25(20(24)19(26)23-12-11-22)30(28,29)15-17-5-3-2-4-6-17/h2-10,20H,11-15,22H2,1H3,(H,23,26)