4-(1-benzothiophen-2-yl)-2-methyl-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1H-quinazoline

Systemtic Name: 4-(1-benzothiophen-2-yl)-2-methyl-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1H-quinazoline Openeye Name: 4-(benzothiophen-2-yl)-2-methyl-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1H-quinazoline CAS Name: 4-(1-benzothiophen-2-yl)-2-methyl-2-[4-[(4-methyl-1-piperazinyl)methyl]phenyl]-1H-quinazoline IUPAC Name: 4-(1-benzothiophen-2-yl)-2-methyl-2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1H-quinazoline Traditional Name: 4-(benzothiophen-2-yl)-2-methyl-2-[4-[(4-methylpiperazino)methyl]phenyl]-1H-quinazoline Formula: C29H30N4S MolecularWeight: 466.6403

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Descriptors Computed from Structure

Canonical SMILES:

CC1(NC2=CC=CC=C2C(=N1)C3=CC4=CC=CC=C4S3)C5=CC=C(C=C5)CN6CCN(CC6)C

Isomeric SMILES

CC1(NC2=CC=CC=C2C(=N1)C3=CC4=CC=CC=C4S3)C5=CC=C(C=C5)CN6CCN(CC6)C

InChI

InChI=1S/C29H30N4S/c1-29(23-13-11-21(12-14-23)20-33-17-15-32(2)16-18-33)30-25-9-5-4-8-24(25)28(31-29)27-19-22-7-3-6-10-26(22)34-27/h3-14,19,30H,15-18,20H2,1-2H3