N-[4-[(3,4-dichlorophenyl)carbamoylamino]-3-oxidanyl-phenyl]-2-dodecylsulfonyl-butanamide

Systemtic Name: N-[4-[(3,4-dichlorophenyl)carbamoylamino]-3-oxidanyl-phenyl]-2-dodecylsulfonyl-butanamide Openeye Name: N-[4-[(3,4-dichlorophenyl)carbamoylamino]-3-hydroxy-phenyl]-2-dodecylsulfonyl-butanamide CAS Name: N-[4-[[(3,4-dichloroanilino)-oxomethyl]amino]-3-hydroxyphenyl]-2-dodecylsulfonylbutanamide IUPAC Name: N-[4-[(3,4-dichlorophenyl)carbamoylamino]-3-hydroxyphenyl]-2-dodecylsulfonylbutanamide Traditional Name: N-[4-[(3,4-dichlorophenyl)carbamoylamino]-3-hydroxy-phenyl]-2-laurylsulfonyl-butyramide Formula: C29H41Cl2N3O5S MolecularWeight: 614.62394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCS(=O)(=O)C(CC)C(=O)NC1=CC(=C(C=C1)NC(=O)NC2=CC(=C(C=C2)Cl)Cl)O

Isomeric SMILES

CCCCCCCCCCCCS(=O)(=O)C(CC)C(=O)NC1=CC(=C(C=C1)NC(=O)NC2=CC(=C(C=C2)Cl)Cl)O

InChI

InChI=1S/C29H41Cl2N3O5S/c1-3-5-6-7-8-9-10-11-12-13-18-40(38,39)27(4-2)28(36)32-22-15-17-25(26(35)20-22)34-29(37)33-21-14-16-23(30)24(31)19-21/h14-17,19-20,27,35H,3-13,18H2,1-2H3,(H,32,36)(H2,33,34,37)