3-(4-methoxyphenyl)-1-methyl-1-[[6-methyl-7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methyl]thiourea

Systemtic Name: 3-(4-methoxyphenyl)-1-methyl-1-[[6-methyl-7-nitro-2,3-bis(oxidanylidene)-1,4-dihydroquinoxalin-5-yl]methyl]thiourea Openeye Name: 3-(4-methoxyphenyl)-1-methyl-1-[(6-methyl-7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]thiourea CAS Name: 3-(4-methoxyphenyl)-1-methyl-1-[(6-methyl-7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]thiourea IUPAC Name: 3-(4-methoxyphenyl)-1-methyl-1-[(6-methyl-7-nitro-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)methyl]thiourea Traditional Name: 1-[(2,3-diketo-6-methyl-7-nitro-1,4-dihydroquinoxalin-5-yl)methyl]-3-(4-methoxyphenyl)-1-methyl-thiourea Formula: C19H19N5O5S MolecularWeight: 429.44966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1CN(C)C(=S)NC3=CC=C(C=C3)OC)NC(=O)C(=O)N2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C2C(=C1CN(C)C(=S)NC3=CC=C(C=C3)OC)NC(=O)C(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O5S/c1-10-13(9-23(2)19(30)20-11-4-6-12(29-3)7-5-11)16-14(8-15(10)24(27)28)21-17(25)18(26)22-16/h4-8H,9H2,1-3H3,(H,20,30)(H,21,25)(H,22,26)