8-[[3-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid

Systemtic Name: 8-[[3-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid Openeye Name: 8-[[3-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxo-1-phenyl-ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid CAS Name: 8-[[3-[[2-[(9-ethyl-3-carbazolyl)amino]-2-oxo-1-phenylethyl]thio]anilino]-oxomethyl]-1-naphthalenecarboxylic acid IUPAC Name: 8-[[3-[2-[(9-ethylcarbazol-3-yl)amino]-2-oxo-1-phenylethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid Traditional Name: 8-[[3-[[2-[(9-ethylcarbazol-3-yl)amino]-2-keto-1-phenyl-ethyl]thio]phenyl]carbamoyl]-1-naphthoic acid Formula: C40H31N3O4S MolecularWeight: 649.75684

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC(=C4)NC(=O)C5=CC=CC6=C5C(=CC=C6)C(=O)O)C7=CC=CC=C71

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC(=C4)NC(=O)C5=CC=CC6=C5C(=CC=C6)C(=O)O)C7=CC=CC=C71

InChI

InChI=1S/C40H31N3O4S/c1-2-43-34-20-7-6-17-30(34)33-24-28(21-22-35(33)43)42-39(45)37(26-11-4-3-5-12-26)48-29-16-10-15-27(23-29)41-38(44)31-18-8-13-25-14-9-19-32(36(25)31)40(46)47/h3-24,37H,2H2,1H3,(H,41,44)(H,42,45)(H,46,47)