1-[(4-morpholin-4-yl-6-phenylazanyl-1,3,5-triazin-2-yl)amino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(4-morpholin-4-yl-6-phenylazanyl-1,3,5-triazin-2-yl)amino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(4-anilino-6-morpholino-1,3,5-triazin-2-yl)amino]thiourea CAS Name: 1-[[4-anilino-6-(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[(4-anilino-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(4-anilino-6-morpholino-s-triazin-2-yl)amino]thiourea Formula: C17H22N8OS MolecularWeight: 386.47458

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NNC1=NC(=NC(=N1)NC2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

C=CCNC(=S)NNC1=NC(=NC(=N1)NC2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C17H22N8OS/c1-2-8-18-17(27)24-23-15-20-14(19-13-6-4-3-5-7-13)21-16(22-15)25-9-11-26-12-10-25/h2-7H,1,8-12H2,(H2,18,24,27)(H2,19,20,21,22,23)