1-[(E)-(2,3-dimethyl-1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-6-ylidene)methyl]imino-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-(2,3-dimethyl-1-oxidanidyl-4-oxidanyl-quinoxalin-1-ium-6-ylidene)methyl]imino-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-(4-hydroxy-2,3-dimethyl-1-oxido-quinoxalin-1-ium-6-ylidene)methyl]imino-thiourea CAS Name: 1-[(E)-(4-hydroxy-2,3-dimethyl-1-oxido-6-quinoxalin-1-iumylidene)methyl]imino-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-(4-hydroxy-2,3-dimethyl-1-oxidoquinoxalin-1-ium-6-ylidene)methyl]imino-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-(4-hydroxy-2,3-dimethyl-1-oxido-quinoxalin-1-ium-6-ylidene)methyl]imino-thiourea Formula: C15H17N5O2S MolecularWeight: 331.39278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=C2C=CC(=CN=NC(=S)NCC=C)C=C2N1O)[O-])C

Isomeric SMILES

CC1=C([N+](=C2C=C/C(=C\N=NC(=S)NCC=C)/C=C2N1O)[O-])C

InChI

InChI=1S/C15H17N5O2S/c1-4-7-16-15(23)18-17-9-12-5-6-13-14(8-12)20(22)11(3)10(2)19(13)21/h4-6,8-9,22H,1,7H2,2-3H3,(H,16,23)/b12-9+,18-17?