1-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one

Systemtic Name: 1-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one Openeye Name: 1-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-3-(1,3,3-trimethylindolin-2-ylidene)propan-2-one CAS Name: 1-[(6-chloro-1H-benzimidazol-2-yl)thio]-3-(1,3,3-trimethyl-2-indolylidene)-2-propanone IUPAC Name: 1-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-3-(1,3,3-trimethylindol-2-ylidene)propan-2-one Traditional Name: 1-[(6-chloro-1H-benzimidazol-2-yl)thio]-3-(1,3,3-trimethylindolin-2-ylidene)acetone Formula: C21H20ClN3OS MolecularWeight: 397.921

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC(=O)CSC3=NC4=C(N3)C=C(C=C4)Cl)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=CC(=O)CSC3=NC4=C(N3)C=C(C=C4)Cl)C)C

InChI

InChI=1S/C21H20ClN3OS/c1-21(2)15-6-4-5-7-18(15)25(3)19(21)11-14(26)12-27-20-23-16-9-8-13(22)10-17(16)24-20/h4-11H,12H2,1-3H3,(H,23,24)