N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2,4-bis(oxidanylidene)-3-phenethyl-1H-quinazoline-7-carboxamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2,4-bis(oxidanylidene)-3-phenethyl-1H-quinazoline-7-carboxamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2,4-dioxo-3-phenethyl-1H-quinazoline-7-carboxamide CAS Name: N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]-2,4-dioxo-3-phenethyl-1H-quinazoline-7-carboxamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2,4-dioxo-3-phenethyl-1H-quinazoline-7-carboxamide Traditional Name: 2,4-diketo-N-[3-[4-(4-methoxyphenyl)piperazino]propyl]-3-phenethyl-1H-quinazoline-7-carboxamide Formula: C31H35N5O4 MolecularWeight: 541.6407

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=CC4=C(C=C3)C(=O)N(C(=O)N4)CCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=CC4=C(C=C3)C(=O)N(C(=O)N4)CCC5=CC=CC=C5

InChI

InChI=1S/C31H35N5O4/c1-40-26-11-9-25(10-12-26)35-20-18-34(19-21-35)16-5-15-32-29(37)24-8-13-27-28(22-24)33-31(39)36(30(27)38)17-14-23-6-3-2-4-7-23/h2-4,6-13,22H,5,14-21H2,1H3,(H,32,37)(H,33,39)