4-azanyl-5-(2-chloranylphenothiazin-10-yl)carbonyl-2-[(4-methylphenyl)amino]thiophene-3-carbonitrile

Systemtic Name: 4-azanyl-5-(2-chloranylphenothiazin-10-yl)carbonyl-2-[(4-methylphenyl)amino]thiophene-3-carbonitrile Openeye Name: 4-amino-5-(2-chlorophenothiazine-10-carbonyl)-2-(4-methylanilino)thiophene-3-carbonitrile CAS Name: 4-amino-5-[(2-chloro-10-phenothiazinyl)-oxomethyl]-2-(4-methylanilino)-3-thiophenecarbonitrile IUPAC Name: 4-amino-5-(2-chlorophenothiazine-10-carbonyl)-2-(4-methylanilino)thiophene-3-carbonitrile Traditional Name: 4-amino-5-(2-chlorophenothiazine-10-carbonyl)-2-(p-toluidino)thiophene-3-carbonitrile Formula: C25H17ClN4OS2 MolecularWeight: 489.01168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)N3C4=CC=CC=C4SC5=C3C=C(C=C5)Cl)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)N3C4=CC=CC=C4SC5=C3C=C(C=C5)Cl)N)C#N

InChI

InChI=1S/C25H17ClN4OS2/c1-14-6-9-16(10-7-14)29-24-17(13-27)22(28)23(33-24)25(31)30-18-4-2-3-5-20(18)32-21-11-8-15(26)12-19(21)30/h2-12,29H,28H2,1H3