3-(2,3-dimethylquinoxalin-6-yl)-1-(phenylmethyl)-1-propyl-thiourea

Systemtic Name: 3-(2,3-dimethylquinoxalin-6-yl)-1-(phenylmethyl)-1-propyl-thiourea Openeye Name: 1-benzyl-3-(2,3-dimethylquinoxalin-6-yl)-1-propyl-thiourea CAS Name: 3-(2,3-dimethyl-6-quinoxalinyl)-1-(phenylmethyl)-1-propylthiourea IUPAC Name: 1-benzyl-3-(2,3-dimethylquinoxalin-6-yl)-1-propylthiourea Traditional Name: 1-benzyl-3-(2,3-dimethylquinoxalin-6-yl)-1-propyl-thiourea Formula: C21H24N4S MolecularWeight: 364.50706

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC=C1)C(=S)NC2=CC3=C(C=C2)N=C(C(=N3)C)C

Isomeric SMILES

CCCN(CC1=CC=CC=C1)C(=S)NC2=CC3=C(C=C2)N=C(C(=N3)C)C

InChI

InChI=1S/C21H24N4S/c1-4-12-25(14-17-8-6-5-7-9-17)21(26)24-18-10-11-19-20(13-18)23-16(3)15(2)22-19/h5-11,13H,4,12,14H2,1-3H3,(H,24,26)