4-[(4-bromophenyl)methylcarbamoylamino]-3-phenyl-N,N-di(propan-2-yl)-2-pyridin-3-yl-butanamide

Systemtic Name: 4-[(4-bromophenyl)methylcarbamoylamino]-3-phenyl-N,N-di(propan-2-yl)-2-pyridin-3-yl-butanamide Openeye Name: 4-[(4-bromophenyl)methylcarbamoylamino]-N,N-diisopropyl-3-phenyl-2-(3-pyridyl)butanamide CAS Name: 4-[[[(4-bromophenyl)methylamino]-oxomethyl]amino]-3-phenyl-N,N-di(propan-2-yl)-2-(3-pyridinyl)butanamide IUPAC Name: 4-[(4-bromophenyl)methylcarbamoylamino]-3-phenyl-N,N-di(propan-2-yl)-2-pyridin-3-ylbutanamide Traditional Name: 4-[(4-bromobenzyl)carbamoylamino]-N,N-diisopropyl-3-phenyl-2-(3-pyridyl)butyramide Formula: C29H35BrN4O2 MolecularWeight: 551.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)C(C1=CN=CC=C1)C(CNC(=O)NCC2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CC(C)N(C(C)C)C(=O)C(C1=CN=CC=C1)C(CNC(=O)NCC2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C29H35BrN4O2/c1-20(2)34(21(3)4)28(35)27(24-11-8-16-31-18-24)26(23-9-6-5-7-10-23)19-33-29(36)32-17-22-12-14-25(30)15-13-22/h5-16,18,20-21,26-27H,17,19H2,1-4H3,(H2,32,33,36)