1-[[(E)-[8-bromanyl-5-methoxy-2-methyl-4,7-bis(oxidanylidene)chromen-6-ylidene]methyl]amino]-3-methyl-thiourea

Systemtic Name: 1-[[(E)-[8-bromanyl-5-methoxy-2-methyl-4,7-bis(oxidanylidene)chromen-6-ylidene]methyl]amino]-3-methyl-thiourea Openeye Name: 1-[[(E)-(8-bromo-5-methoxy-2-methyl-4,7-dioxo-chromen-6-ylidene)methyl]amino]-3-methyl-thiourea CAS Name: 1-[[(E)-(8-bromo-5-methoxy-2-methyl-4,7-dioxo-1-benzopyran-6-ylidene)methyl]amino]-3-methylthiourea IUPAC Name: 1-[[(E)-(8-bromo-5-methoxy-2-methyl-4,7-dioxochromen-6-ylidene)methyl]amino]-3-methylthiourea Traditional Name: 1-[[(E)-(8-bromo-4,7-diketo-5-methoxy-2-methyl-chromen-6-ylidene)methyl]amino]-3-methyl-thiourea Formula: C14H14BrN3O4S MolecularWeight: 400.24766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C2=C(C(=CNNC(=S)NC)C(=O)C(=C2O1)Br)OC

Isomeric SMILES

CC1=CC(=O)C2=C(/C(=C\NNC(=S)NC)/C(=O)C(=C2O1)Br)OC

InChI

InChI=1S/C14H14BrN3O4S/c1-6-4-8(19)9-12(21-3)7(5-17-18-14(23)16-2)11(20)10(15)13(9)22-6/h4-5,17H,1-3H3,(H2,16,18,23)/b7-5-