(2S)-N1-[5-(1H-indazol-5-yl)-1,3,4-thiadiazol-2-yl]-3-naphthalen-2-yl-propane-1,2-diamine

Systemtic Name: (2S)-N1-[5-(1H-indazol-5-yl)-1,3,4-thiadiazol-2-yl]-3-naphthalen-2-yl-propane-1,2-diamine Openeye Name: (2S)-N1-[5-(1H-indazol-5-yl)-1,3,4-thiadiazol-2-yl]-3-(2-naphthyl)propane-1,2-diamine CAS Name: (2S)-N1-[5-(1H-indazol-5-yl)-1,3,4-thiadiazol-2-yl]-3-(2-naphthalenyl)propane-1,2-diamine IUPAC Name: (2S)-1-N-[5-(1H-indazol-5-yl)-1,3,4-thiadiazol-2-yl]-3-naphthalen-2-ylpropane-1,2-diamine Traditional Name: [(2S)-2-amino-3-(2-naphthyl)propyl]-[5-(1H-indazol-5-yl)-1,3,4-thiadiazol-2-yl]amine Formula: C22H20N6S MolecularWeight: 400.4994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CC(CNC3=NN=C(S3)C4=CC5=C(C=C4)NN=C5)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C[C@@H](CNC3=NN=C(S3)C4=CC5=C(C=C4)NN=C5)N

InChI

InChI=1S/C22H20N6S/c23-19(10-14-5-6-15-3-1-2-4-16(15)9-14)13-24-22-28-27-21(29-22)17-7-8-20-18(11-17)12-25-26-20/h1-9,11-12,19H,10,13,23H2,(H,24,28)(H,25,26)/t19-/m0/s1