4,6,7-trimethyl-2-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]quinazoline

Systemtic Name: 4,6,7-trimethyl-2-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]quinazoline Openeye Name: 4,6,7-trimethyl-2-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]quinazoline CAS Name: 4,6,7-trimethyl-2-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]quinazoline IUPAC Name: 4,6,7-trimethyl-2-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]quinazoline Traditional Name: 4,6,7-trimethyl-2-[4-(2-thenyl)-1,4-diazepan-1-yl]quinazoline Formula: C21H26N4S MolecularWeight: 366.52294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCCN(CC3)CC4=CC=CS4)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCCN(CC3)CC4=CC=CS4)C)C

InChI

InChI=1S/C21H26N4S/c1-15-12-19-17(3)22-21(23-20(19)13-16(15)2)25-8-5-7-24(9-10-25)14-18-6-4-11-26-18/h4,6,11-13H,5,7-10,14H2,1-3H3