3-[(2-azanyl-2-methyl-3-phenyl-propoxy)methyl]-5-[methylsulfonyl(propyl)amino]-N-pent-3-yn-2-yl-benzamide

Systemtic Name: 3-[(2-azanyl-2-methyl-3-phenyl-propoxy)methyl]-5-[methylsulfonyl(propyl)amino]-N-pent-3-yn-2-yl-benzamide Openeye Name: 3-[(2-amino-2-methyl-3-phenyl-propoxy)methyl]-N-(1-methylbut-2-ynyl)-5-[methylsulfonyl(propyl)amino]benzamide CAS Name: 3-[(2-amino-2-methyl-3-phenylpropoxy)methyl]-5-[methylsulfonyl(propyl)amino]-N-pent-3-yn-2-ylbenzamide IUPAC Name: 3-[(2-amino-2-methyl-3-phenylpropoxy)methyl]-5-[methylsulfonyl(propyl)amino]-N-pent-3-yn-2-ylbenzamide Traditional Name: 3-[(2-amino-2-methyl-3-phenyl-propoxy)methyl]-5-[mesyl(propyl)amino]-N-(1-methylbut-2-ynyl)benzamide Formula: C27H37N3O4S MolecularWeight: 499.66538

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC(=CC(=C1)COCC(C)(CC2=CC=CC=C2)N)C(=O)NC(C)C#CC)S(=O)(=O)C

Isomeric SMILES

CCCN(C1=CC(=CC(=C1)COCC(C)(CC2=CC=CC=C2)N)C(=O)NC(C)C#CC)S(=O)(=O)C

InChI

InChI=1S/C27H37N3O4S/c1-6-11-21(3)29-26(31)24-15-23(16-25(17-24)30(14-7-2)35(5,32)33)19-34-20-27(4,28)18-22-12-9-8-10-13-22/h8-10,12-13,15-17,21H,7,14,18-20,28H2,1-5H3,(H,29,31)