3-(6-chloranyl-1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)-N-[(3-methylthiophen-2-yl)methyl]propan-1-amine

Systemtic Name: 3-(6-chloranyl-1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)-N-[(3-methylthiophen-2-yl)methyl]propan-1-amine Openeye Name: 3-(6-chloro-1,2-dimethyl-5-oxo-phenothiazin-10-yl)-N-[(3-methyl-2-thienyl)methyl]propan-1-amine CAS Name: 3-(6-chloro-1,2-dimethyl-5-oxo-10-phenothiazinyl)-N-[(3-methyl-2-thiophenyl)methyl]-1-propanamine IUPAC Name: 3-(6-chloro-1,2-dimethyl-5-oxophenothiazin-10-yl)-N-[(3-methylthiophen-2-yl)methyl]propan-1-amine Traditional Name: 3-(6-chloro-5-keto-1,2-dimethyl-phenothiazin-10-yl)propyl-[(3-methyl-2-thienyl)methyl]amine Formula: C23H25ClN2OS2 MolecularWeight: 445.0404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)S(=O)C3=C(N2CCCNCC4=C(C=CS4)C)C=CC=C3Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)S(=O)C3=C(N2CCCNCC4=C(C=CS4)C)C=CC=C3Cl)C

InChI

InChI=1S/C23H25ClN2OS2/c1-15-8-9-21-22(17(15)3)26(19-7-4-6-18(24)23(19)29(21)27)12-5-11-25-14-20-16(2)10-13-28-20/h4,6-10,13,25H,5,11-12,14H2,1-3H3