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

Systemtic Name: N-(2-azanylethyl)-1-(3-methoxyphenyl)carbonyl-3-(phenylmethyl)sulfonyl-imidazolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-(3-methoxybenzoyl)imidazolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(3-methoxyphenyl)-oxomethyl]-3-(phenylmethyl)sulfonyl-2-imidazolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-(3-methoxybenzoyl)imidazolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-benzylsulfonyl-3-m-anisoyl-imidazolidine-2-carboxamide Formula: C21H26N4O5S MolecularWeight: 446.51994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NCCN)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NCCN)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O5S/c1-30-18-9-5-8-17(14-18)21(27)24-12-13-25(20(24)19(26)23-11-10-22)31(28,29)15-16-6-3-2-4-7-16/h2-9,14,20H,10-13,15,22H2,1H3,(H,23,26)