2-[[5-(4-methylphenyl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]amino]ethylazanium

Systemtic Name: 2-[[5-(4-methylphenyl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]amino]ethylazanium Openeye Name: 2-[[3-allyl-4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-2-yl]amino]ethylammonium CAS Name: 2-[[5-(4-methylphenyl)-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl]amino]ethylammonium IUPAC Name: 2-[[5-(4-methylphenyl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]amino]ethylazanium Traditional Name: 2-[[3-allyl-4-keto-5-(p-tolyl)thieno[2,3-d]pyrimidin-2-yl]amino]ethylammonium Formula: C18H21N4OS+ MolecularWeight: 341.45054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)NCC[NH3+])CC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)NCC[NH3+])CC=C

InChI

InChI=1S/C18H20N4OS/c1-3-10-22-17(23)15-14(13-6-4-12(2)5-7-13)11-24-16(15)21-18(22)20-9-8-19/h3-7,11H,1,8-10,19H2,2H3,(H,20,21)/p+1