N-[[3-(aminomethyl)phenyl]methyl]-1-(4-methylphenyl)carbonyl-3-methylsulfonyl-imidazolidine-2-carboxamide

Systemtic Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(4-methylphenyl)carbonyl-3-methylsulfonyl-imidazolidine-2-carboxamide Openeye Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(4-methylbenzoyl)-3-methylsulfonyl-imidazolidine-2-carboxamide CAS Name: N-[[3-(aminomethyl)phenyl]methyl]-1-[(4-methylphenyl)-oxomethyl]-3-methylsulfonyl-2-imidazolidinecarboxamide IUPAC Name: N-[[3-(aminomethyl)phenyl]methyl]-1-(4-methylbenzoyl)-3-methylsulfonylimidazolidine-2-carboxamide Traditional Name: N-[3-(aminomethyl)benzyl]-1-mesyl-3-p-toluoyl-imidazolidine-2-carboxamide Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(C2C(=O)NCC3=CC=CC(=C3)CN)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(C2C(=O)NCC3=CC=CC(=C3)CN)S(=O)(=O)C

InChI

InChI=1S/C21H26N4O4S/c1-15-6-8-18(9-7-15)21(27)24-10-11-25(30(2,28)29)20(24)19(26)23-14-17-5-3-4-16(12-17)13-22/h3-9,12,20H,10-11,13-14,22H2,1-2H3,(H,23,26)