1-[2-(2-ethyl-4-oxidanylidene-quinazolin-3-yl)ethyl]-3-phenyl-1-propan-2-yl-thiourea

Systemtic Name: 1-[2-(2-ethyl-4-oxidanylidene-quinazolin-3-yl)ethyl]-3-phenyl-1-propan-2-yl-thiourea Openeye Name: 1-[2-(2-ethyl-4-oxo-quinazolin-3-yl)ethyl]-1-isopropyl-3-phenyl-thiourea CAS Name: 1-[2-(2-ethyl-4-oxo-3-quinazolinyl)ethyl]-3-phenyl-1-propan-2-ylthiourea IUPAC Name: 1-[2-(2-ethyl-4-oxoquinazolin-3-yl)ethyl]-3-phenyl-1-propan-2-ylthiourea Traditional Name: 1-[2-(2-ethyl-4-keto-quinazolin-3-yl)ethyl]-1-isopropyl-3-phenyl-thiourea Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=O)N1CCN(C(C)C)C(=S)NC3=CC=CC=C3

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=O)N1CCN(C(C)C)C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C22H26N4OS/c1-4-20-24-19-13-9-8-12-18(19)21(27)26(20)15-14-25(16(2)3)22(28)23-17-10-6-5-7-11-17/h5-13,16H,4,14-15H2,1-3H3,(H,23,28)