(E)-3-(2,4-dipropoxyphenyl)-1-(10H-phenothiazin-2-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(2,4-dipropoxyphenyl)-1-(10H-phenothiazin-2-yl)prop-2-en-1-one Openeye Name: (E)-3-(2,4-dipropoxyphenyl)-1-(10H-phenothiazin-2-yl)prop-2-en-1-one CAS Name: (E)-3-(2,4-dipropoxyphenyl)-1-(10H-phenothiazin-2-yl)-2-propen-1-one IUPAC Name: (E)-3-(2,4-dipropoxyphenyl)-1-(10H-phenothiazin-2-yl)prop-2-en-1-one Traditional Name: (E)-3-(2,4-dipropoxyphenyl)-1-(10H-phenothiazin-2-yl)prop-2-en-1-one Formula: C27H27NO3S MolecularWeight: 445.57318

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)C=CC(=O)C2=CC3=C(C=C2)SC4=CC=CC=C4N3)OCCC

Isomeric SMILES

CCCOC1=CC(=C(C=C1)/C=C/C(=O)C2=CC3=C(C=C2)SC4=CC=CC=C4N3)OCCC

InChI

InChI=1S/C27H27NO3S/c1-3-15-30-21-12-9-19(25(18-21)31-16-4-2)10-13-24(29)20-11-14-27-23(17-20)28-22-7-5-6-8-26(22)32-27/h5-14,17-18,28H,3-4,15-16H2,1-2H3/b13-10+