10-[1-[ethyl(2-hydroxyethyl)amino]propyl]-N-(phenylmethyl)phenothiazine-2-carbothioamide

Systemtic Name: 10-[1-[ethyl(2-hydroxyethyl)amino]propyl]-N-(phenylmethyl)phenothiazine-2-carbothioamide Openeye Name: N-benzyl-10-[1-[ethyl(2-hydroxyethyl)amino]propyl]phenothiazine-2-carbothioamide CAS Name: 10-[1-[ethyl(2-hydroxyethyl)amino]propyl]-N-(phenylmethyl)-2-phenothiazinecarbothioamide IUPAC Name: N-benzyl-10-[1-[ethyl(2-hydroxyethyl)amino]propyl]phenothiazine-2-carbothioamide Traditional Name: N-benzyl-10-[1-[ethyl(2-hydroxyethyl)amino]propyl]phenothiazine-2-carbothioamide Formula: C27H31N3OS2 MolecularWeight: 477.68454

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1C2=CC=CC=C2SC3=C1C=C(C=C3)C(=S)NCC4=CC=CC=C4)N(CC)CCO

Isomeric SMILES

CCC(N1C2=CC=CC=C2SC3=C1C=C(C=C3)C(=S)NCC4=CC=CC=C4)N(CC)CCO

InChI

InChI=1S/C27H31N3OS2/c1-3-26(29(4-2)16-17-31)30-22-12-8-9-13-24(22)33-25-15-14-21(18-23(25)30)27(32)28-19-20-10-6-5-7-11-20/h5-15,18,26,31H,3-4,16-17,19H2,1-2H3,(H,28,32)