7-[methyl-[2-(4-methylphenoxy)ethyl]carbamoyl]-3-prop-2-enyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 7-[methyl-[2-(4-methylphenoxy)ethyl]carbamoyl]-3-prop-2-enyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-allyl-7-[methyl-[2-(4-methylphenoxy)ethyl]carbamoyl]-2-thioxo-quinazolin-4-olate CAS Name: 7-[[methyl-[2-(4-methylphenoxy)ethyl]amino]-oxomethyl]-3-prop-2-enyl-2-sulfanylidene-4-quinazolinolate IUPAC Name: 7-[methyl-[2-(4-methylphenoxy)ethyl]carbamoyl]-3-prop-2-enyl-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-allyl-7-[methyl-[2-(4-methylphenoxy)ethyl]carbamoyl]-2-thioxo-quinazolin-4-olate Formula: C22H22N3O3S- MolecularWeight: 408.49338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCN(C)C(=O)C2=CC3=NC(=S)N(C(=C3C=C2)[O-])CC=C

Isomeric SMILES

CC1=CC=C(C=C1)OCCN(C)C(=O)C2=CC3=NC(=S)N(C(=C3C=C2)[O-])CC=C

InChI

InChI=1S/C22H23N3O3S/c1-4-11-25-21(27)18-10-7-16(14-19(18)23-22(25)29)20(26)24(3)12-13-28-17-8-5-15(2)6-9-17/h4-10,14,27H,1,11-13H2,2-3H3/p-1