4-(1,3-benzothiazol-2-yl)-N-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]aniline

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]aniline Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[[3-chloro-5-methoxy-4-(2-thienylmethoxy)phenyl]methyl]aniline CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]aniline IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]aniline Traditional Name: [4-(1,3-benzothiazol-2-yl)phenyl]-[3-chloro-5-methoxy-4-(2-thenyloxy)benzyl]amine Formula: C26H21ClN2O2S2 MolecularWeight: 493.04014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3)Cl)OCC5=CC=CS5

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3)Cl)OCC5=CC=CS5

InChI

InChI=1S/C26H21ClN2O2S2/c1-30-23-14-17(13-21(27)25(23)31-16-20-5-4-12-32-20)15-28-19-10-8-18(9-11-19)26-29-22-6-2-3-7-24(22)33-26/h2-14,28H,15-16H2,1H3