3-(3-ethoxypropyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-(phenylmethyl)thiourea

Systemtic Name: 3-(3-ethoxypropyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(3-ethoxypropyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea CAS Name: 3-(3-ethoxypropyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(3-ethoxypropyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea Traditional Name: 1-benzyl-3-(3-ethoxypropyl)-1-[(4-keto-1H-quinazolin-2-yl)methyl]thiourea Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)N(CC1=CC=CC=C1)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCOCCCNC(=S)N(CC1=CC=CC=C1)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C22H26N4O2S/c1-2-28-14-8-13-23-22(29)26(15-17-9-4-3-5-10-17)16-20-24-19-12-7-6-11-18(19)21(27)25-20/h3-7,9-12H,2,8,13-16H2,1H3,(H,23,29)(H,24,25,27)