8-[[3-[1-(naphthalen-1-ylamino)-1-oxidanylidene-butan-2-yl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid

Systemtic Name: 8-[[3-[1-(naphthalen-1-ylamino)-1-oxidanylidene-butan-2-yl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid Openeye Name: 8-[[3-[1-(1-naphthylcarbamoyl)propylsulfanyl]phenyl]carbamoyl]naphthalene-1-carboxylic acid CAS Name: 8-[[3-[[1-(1-naphthalenylamino)-1-oxobutan-2-yl]thio]anilino]-oxomethyl]-1-naphthalenecarboxylic acid IUPAC Name: 8-[[3-[1-(naphthalen-1-ylamino)-1-oxobutan-2-yl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid Traditional Name: 8-[[3-[1-(1-naphthylcarbamoyl)propylthio]phenyl]carbamoyl]-1-naphthoic acid Formula: C32H26N2O4S MolecularWeight: 534.62484

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=CC=CC(=C3)NC(=O)C4=CC=CC5=C4C(=CC=C5)C(=O)O

Isomeric SMILES

CCC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=CC=CC(=C3)NC(=O)C4=CC=CC5=C4C(=CC=C5)C(=O)O

InChI

InChI=1S/C32H26N2O4S/c1-2-28(31(36)34-27-18-7-10-20-9-3-4-15-24(20)27)39-23-14-8-13-22(19-23)33-30(35)25-16-5-11-21-12-6-17-26(29(21)25)32(37)38/h3-19,28H,2H2,1H3,(H,33,35)(H,34,36)(H,37,38)