N-[4-(2-azanylidenepyrrolidin-1-yl)phenyl]-2-[(4-chlorophenyl)carbamoylamino]-3-methyl-butanamide

Systemtic Name: N-[4-(2-azanylidenepyrrolidin-1-yl)phenyl]-2-[(4-chlorophenyl)carbamoylamino]-3-methyl-butanamide Openeye Name: 2-[(4-chlorophenyl)carbamoylamino]-N-[4-(2-iminopyrrolidin-1-yl)phenyl]-3-methyl-butanamide CAS Name: 2-[[(4-chloroanilino)-oxomethyl]amino]-N-[4-(2-imino-1-pyrrolidinyl)phenyl]-3-methylbutanamide IUPAC Name: 2-[(4-chlorophenyl)carbamoylamino]-N-[4-(2-iminopyrrolidin-1-yl)phenyl]-3-methylbutanamide Traditional Name: 2-[(4-chlorophenyl)carbamoylamino]-N-[4-(2-iminopyrrolidino)phenyl]-3-methyl-butyramide Formula: C22H26ClN5O2 MolecularWeight: 427.92714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)N2CCCC2=N)NC(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=C(C=C1)N2CCCC2=N)NC(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H26ClN5O2/c1-14(2)20(27-22(30)26-17-7-5-15(23)6-8-17)21(29)25-16-9-11-18(12-10-16)28-13-3-4-19(28)24/h5-12,14,20,24H,3-4,13H2,1-2H3,(H,25,29)(H2,26,27,30)