1-[(Z)-[5-nitro-1-(1,3-oxazinan-3-ylmethyl)-2-oxidanylidene-indol-3-ylidene]amino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(Z)-[5-nitro-1-(1,3-oxazinan-3-ylmethyl)-2-oxidanylidene-indol-3-ylidene]amino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(Z)-[5-nitro-1-(1,3-oxazinan-3-ylmethyl)-2-oxo-indolin-3-ylidene]amino]thiourea CAS Name: 1-[(Z)-[5-nitro-1-(1,3-oxazinan-3-ylmethyl)-2-oxo-3-indolylidene]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[(Z)-[5-nitro-1-(1,3-oxazinan-3-ylmethyl)-2-oxoindol-3-ylidene]amino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(Z)-[2-keto-5-nitro-1-(1,3-oxazinan-3-ylmethyl)indolin-3-ylidene]amino]thiourea Formula: C17H20N6O4S MolecularWeight: 404.4435

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NN=C1C2=C(C=CC(=C2)[N+](=O)[O-])N(C1=O)CN3CCCOC3

Isomeric SMILES

C=CCNC(=S)N/N=C\1/C2=C(C=CC(=C2)[N+](=O)[O-])N(C1=O)CN3CCCOC3

InChI

InChI=1S/C17H20N6O4S/c1-2-6-18-17(28)20-19-15-13-9-12(23(25)26)4-5-14(13)22(16(15)24)10-21-7-3-8-27-11-21/h2,4-5,9H,1,3,6-8,10-11H2,(H2,18,20,28)/b19-15-