tert-butyl N-[[[tert-butyl-(2-phenylphenyl)sulfonyl-amino]-propan-2-yl-carbamoyl]amino]-N-(3-carbamimidoylphenyl)carbamate

Systemtic Name: tert-butyl N-[[[tert-butyl-(2-phenylphenyl)sulfonyl-amino]-propan-2-yl-carbamoyl]amino]-N-(3-carbamimidoylphenyl)carbamate Openeye Name: tert-butyl N-[[[tert-butyl-(2-phenylphenyl)sulfonyl-amino]-isopropyl-carbamoyl]amino]-N-(3-carbamimidoylphenyl)carbamate CAS Name: N-[[[[tert-butyl-(2-phenylphenyl)sulfonylamino]-propan-2-ylamino]-oxomethyl]amino]-N-(3-carbamimidoylphenyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[[tert-butyl-(2-phenylphenyl)sulfonylamino]-propan-2-ylcarbamoyl]amino]-N-(3-carbamimidoylphenyl)carbamate Traditional Name: N-(3-amidinophenyl)-N-[[[tert-butyl-(2-phenylphenyl)sulfonyl-amino]-isopropyl-carbamoyl]amino]carbamic acid tert-butyl ester Formula: C32H42N6O5S MolecularWeight: 622.77808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(=O)NN(C1=CC=CC(=C1)C(=N)N)C(=O)OC(C)(C)C)N(C(C)(C)C)S(=O)(=O)C2=CC=CC=C2C3=CC=CC=C3

Isomeric SMILES

CC(C)N(C(=O)NN(C1=CC=CC(=C1)C(=N)N)C(=O)OC(C)(C)C)N(C(C)(C)C)S(=O)(=O)C2=CC=CC=C2C3=CC=CC=C3

InChI

InChI=1S/C32H42N6O5S/c1-22(2)37(29(39)35-36(30(40)43-32(6,7)8)25-18-14-17-24(21-25)28(33)34)38(31(3,4)5)44(41,42)27-20-13-12-19-26(27)23-15-10-9-11-16-23/h9-22H,1-8H3,(H3,33,34)(H,35,39)