1-[4-(1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl)sulfanylphenyl]-3-phenyl-thiourea

Systemtic Name: 1-[4-(1-oxidanylidene-1-phenothiazin-10-yl-butan-2-yl)sulfanylphenyl]-3-phenyl-thiourea Openeye Name: 1-[4-[1-(phenothiazine-10-carbonyl)propylsulfanyl]phenyl]-3-phenyl-thiourea CAS Name: 1-[4-[[1-oxo-1-(10-phenothiazinyl)butan-2-yl]thio]phenyl]-3-phenylthiourea IUPAC Name: 1-[4-(1-oxo-1-phenothiazin-10-ylbutan-2-yl)sulfanylphenyl]-3-phenylthiourea Traditional Name: 1-[4-[1-(phenothiazine-10-carbonyl)propylthio]phenyl]-3-phenyl-thiourea Formula: C29H25N3OS3 MolecularWeight: 527.7233

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=CC=C(C=C4)NC(=S)NC5=CC=CC=C5

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=CC=C(C=C4)NC(=S)NC5=CC=CC=C5

InChI

InChI=1S/C29H25N3OS3/c1-2-25(28(33)32-23-12-6-8-14-26(23)36-27-15-9-7-13-24(27)32)35-22-18-16-21(17-19-22)31-29(34)30-20-10-4-3-5-11-20/h3-19,25H,2H2,1H3,(H2,30,31,34)