N-[2-[3-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]naphthalene-2-carboxamide

Systemtic Name: N-[2-[3-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]naphthalene-2-carboxamide Openeye Name: N-[2-[3-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]naphthalene-2-carboxamide CAS Name: N-[2-[3-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]thio]-1-indolyl]ethyl]-2-naphthalenecarboxamide IUPAC Name: N-[2-[3-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]naphthalene-2-carboxamide Traditional Name: N-[2-[3-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thio]indol-1-yl]ethyl]-2-naphthamide Formula: C30H25N3O4S MolecularWeight: 523.6022

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=CN(C4=CC=CC=C43)CCNC(=O)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=CN(C4=CC=CC=C43)CCNC(=O)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C30H25N3O4S/c34-29(32-23-11-12-26-27(16-23)37-19-36-26)18-38-28-17-33(25-8-4-3-7-24(25)28)14-13-31-30(35)22-10-9-20-5-1-2-6-21(20)15-22/h1-12,15-17H,13-14,18-19H2,(H,31,35)(H,32,34)