3-(3-methoxypropyl)-N-[3-[methyl-(phenylmethyl)amino]propyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(3-methoxypropyl)-N-[3-[methyl-(phenylmethyl)amino]propyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-3-(3-methoxypropyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(3-methoxypropyl)-N-[3-[methyl-(phenylmethyl)amino]propyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-3-(3-methoxypropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-4-keto-3-(3-methoxypropyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H30N4O3S MolecularWeight: 454.585

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CCCOC)CC3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CCCOC)CC3=CC=CC=C3

InChI

InChI=1S/C24H30N4O3S/c1-27(17-18-8-4-3-5-9-18)13-6-12-25-22(29)19-10-11-20-21(16-19)26-24(32)28(23(20)30)14-7-15-31-2/h3-5,8-11,16H,6-7,12-15,17H2,1-2H3,(H,25,29)(H,26,32)