1-phenothiazin-10-yl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butan-1-one

Systemtic Name: 1-phenothiazin-10-yl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]butan-1-one Openeye Name: 1-phenothiazin-10-yl-2-(1-phenyltetrazol-5-yl)sulfanyl-butan-1-one CAS Name: 1-(10-phenothiazinyl)-2-[(1-phenyl-5-tetrazolyl)thio]-1-butanone IUPAC Name: 1-phenothiazin-10-yl-2-(1-phenyltetrazol-5-yl)sulfanylbutan-1-one Traditional Name: 1-phenothiazin-10-yl-2-[(1-phenyltetrazol-5-yl)thio]butan-1-one Formula: C23H19N5OS2 MolecularWeight: 445.55986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=NN=NN4C5=CC=CC=C5

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=NN=NN4C5=CC=CC=C5

InChI

InChI=1S/C23H19N5OS2/c1-2-19(31-23-24-25-26-28(23)16-10-4-3-5-11-16)22(29)27-17-12-6-8-14-20(17)30-21-15-9-7-13-18(21)27/h3-15,19H,2H2,1H3