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

Systemtic Name: 1-[4-(1-oxidanylidene-1-phenothiazin-10-yl-propan-2-yl)sulfanylphenyl]-3-phenyl-thiourea Openeye Name: 1-[4-(1-methyl-2-oxo-2-phenothiazin-10-yl-ethyl)sulfanylphenyl]-3-phenyl-thiourea CAS Name: 1-[4-[[1-oxo-1-(10-phenothiazinyl)propan-2-yl]thio]phenyl]-3-phenylthiourea IUPAC Name: 1-[4-(1-oxo-1-phenothiazin-10-ylpropan-2-yl)sulfanylphenyl]-3-phenylthiourea Traditional Name: 1-[4-[(2-keto-1-methyl-2-phenothiazin-10-yl-ethyl)thio]phenyl]-3-phenyl-thiourea Formula: C28H23N3OS3 MolecularWeight: 513.69672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H23N3OS3/c1-19(27(32)31-23-11-5-7-13-25(23)35-26-14-8-6-12-24(26)31)34-22-17-15-21(16-18-22)30-28(33)29-20-9-3-2-4-10-20/h2-19H,1H3,(H2,29,30,33)