1-[(E)-[3-(4-morpholin-4-ylsulfonylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-[3-(4-morpholin-4-ylsulfonylphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-[3-(4-morpholinosulfonylphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]thiourea CAS Name: 1-[(E)-[3-[4-(4-morpholinylsulfonyl)phenyl]-1-phenyl-4-pyrazolyl]methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-[3-(4-morpholin-4-ylsulfonylphenyl)-1-phenylpyrazol-4-yl]methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-[3-(4-morpholinosulfonylphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]thiourea Formula: C24H26N6O3S2 MolecularWeight: 510.63164

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NN=CC1=CN(N=C1C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

C=CCNC(=S)N/N=C/C1=CN(N=C1C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N6O3S2/c1-2-12-25-24(34)27-26-17-20-18-30(21-6-4-3-5-7-21)28-23(20)19-8-10-22(11-9-19)35(31,32)29-13-15-33-16-14-29/h2-11,17-18H,1,12-16H2,(H2,25,27,34)/b26-17+