methyl 4-[2-[(1R)-1-[(3R)-3-methylpiperazin-1-yl]propyl]-4-oxidanylidene-quinazolin-3-yl]butanoate

Systemtic Name: methyl 4-[2-[(1R)-1-[(3R)-3-methylpiperazin-1-yl]propyl]-4-oxidanylidene-quinazolin-3-yl]butanoate Openeye Name: methyl 4-[2-[(1R)-1-[(3R)-3-methylpiperazin-1-yl]propyl]-4-oxo-quinazolin-3-yl]butanoate CAS Name: 4-[2-[(1R)-1-[(3R)-3-methyl-1-piperazinyl]propyl]-4-oxo-3-quinazolinyl]butanoic acid methyl ester IUPAC Name: methyl 4-[2-[(1R)-1-[(3R)-3-methylpiperazin-1-yl]propyl]-4-oxoquinazolin-3-yl]butanoate Traditional Name: 4-[4-keto-2-[(1R)-1-[(3R)-3-methylpiperazino]propyl]quinazolin-3-yl]butyric acid methyl ester Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1CCCC(=O)OC)N3CCNC(C3)C

Isomeric SMILES

CC[C@H](C1=NC2=CC=CC=C2C(=O)N1CCCC(=O)OC)N3CCN[C@@H](C3)C

InChI

InChI=1S/C21H30N4O3/c1-4-18(24-13-11-22-15(2)14-24)20-23-17-9-6-5-8-16(17)21(27)25(20)12-7-10-19(26)28-3/h5-6,8-9,15,18,22H,4,7,10-14H2,1-3H3/t15-,18-/m1/s1