N-[(3-carbamimidoylphenyl)methyl]-4-(1-ethoxyethenyl)-N-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[(3-carbamimidoylphenyl)methyl]-4-(1-ethoxyethenyl)-N-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-piperazine-1-carboxamide Openeye Name: N-[(3-carbamimidoylphenyl)methyl]-4-(1-ethoxyvinyl)-N-(2,4,6-triisopropylphenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-[(3-carbamimidoylphenyl)methyl]-4-(1-ethoxyethenyl)-N-[2,4,6-tri(propan-2-yl)phenyl]sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[(3-carbamimidoylphenyl)methyl]-4-(1-ethoxyethenyl)-N-[2,4,6-tri(propan-2-yl)phenyl]sulfonylpiperazine-1-carboxamide Traditional Name: N-(3-amidinobenzyl)-4-(1-ethoxyvinyl)-N-(2,4,6-triisopropylphenyl)sulfonyl-piperazine-1-carboxamide Formula: C32H47N5O4S MolecularWeight: 597.81168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C)N1CCN(CC1)C(=O)N(CC2=CC=CC(=C2)C(=N)N)S(=O)(=O)C3=C(C=C(C=C3C(C)C)C(C)C)C(C)C

Isomeric SMILES

CCOC(=C)N1CCN(CC1)C(=O)N(CC2=CC=CC(=C2)C(=N)N)S(=O)(=O)C3=C(C=C(C=C3C(C)C)C(C)C)C(C)C

InChI

InChI=1S/C32H47N5O4S/c1-9-41-24(8)35-13-15-36(16-14-35)32(38)37(20-25-11-10-12-26(17-25)31(33)34)42(39,40)30-28(22(4)5)18-27(21(2)3)19-29(30)23(6)7/h10-12,17-19,21-23H,8-9,13-16,20H2,1-7H3,(H3,33,34)