6-methoxy-7-[3-(2-methylpropylsulfonyl)propoxy]-4-piperazin-1-yl-quinazoline

Systemtic Name: 6-methoxy-7-[3-(2-methylpropylsulfonyl)propoxy]-4-piperazin-1-yl-quinazoline Openeye Name: 7-(3-isobutylsulfonylpropoxy)-6-methoxy-4-piperazin-1-yl-quinazoline CAS Name: 6-methoxy-7-[3-(2-methylpropylsulfonyl)propoxy]-4-(1-piperazinyl)quinazoline IUPAC Name: 6-methoxy-7-[3-(2-methylpropylsulfonyl)propoxy]-4-piperazin-1-ylquinazoline Traditional Name: 7-(3-isobutylsulfonylpropoxy)-6-methoxy-4-piperazino-quinazoline Formula: C20H30N4O4S MolecularWeight: 422.5416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)CCCOC1=C(C=C2C(=C1)N=CN=C2N3CCNCC3)OC

Isomeric SMILES

CC(C)CS(=O)(=O)CCCOC1=C(C=C2C(=C1)N=CN=C2N3CCNCC3)OC

InChI

InChI=1S/C20H30N4O4S/c1-15(2)13-29(25,26)10-4-9-28-19-12-17-16(11-18(19)27-3)20(23-14-22-17)24-7-5-21-6-8-24/h11-12,14-15,21H,4-10,13H2,1-3H3