2-[[[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[[(R)-(4-ethylphenyl)-(2-thienyl)methyl]amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]amino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[[(R)-(4-ethylphenyl)-(2-thienyl)methyl]amino]methyl]-1H-quinazolin-4-one Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)NCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C2=CC=CS2)NCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C22H21N3OS/c1-2-15-9-11-16(12-10-15)21(19-8-5-13-27-19)23-14-20-24-18-7-4-3-6-17(18)22(26)25-20/h3-13,21,23H,2,14H2,1H3,(H,24,25,26)/t21-/m1/s1