(E)-1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-3-(3-methyl-2H-thiopyran-6-yl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-3-(3-methyl-2H-thiopyran-6-yl)prop-2-en-1-one Openeye Name: (E)-1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-3-(3-methyl-2H-thiopyran-6-yl)prop-2-en-1-one CAS Name: (E)-1-[4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-3-(3-methyl-2H-thiopyran-6-yl)-2-propen-1-one IUPAC Name: (E)-1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-3-(3-methyl-2H-thiopyran-6-yl)prop-2-en-1-one Traditional Name: (E)-1-[4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazino]-3-(3-methyl-2H-thiopyran-6-yl)prop-2-en-1-one Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(SC1)C=CC(=O)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC

Isomeric SMILES

CC1=CC=C(SC1)/C=C/C(=O)N2CCN(CC2)C3=NC4=CC(=C(C=C4C(=N3)N)OC)OC

InChI

InChI=1S/C23H27N5O3S/c1-15-4-5-16(32-14-15)6-7-21(29)27-8-10-28(11-9-27)23-25-18-13-20(31-3)19(30-2)12-17(18)22(24)26-23/h4-7,12-13H,8-11,14H2,1-3H3,(H2,24,25,26)/b7-6+